Pavinetant

Pavinetant

SCHEMBL29375128

CC[C@H](NC(=O)c1c(NS(C)(=O)=O)c(-c2ccccc2)nc2ccccc12)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TACR3

The experimentally established mechanism targets of Pavinetant. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR3 known ✓ P29371 20/20 1.00
TACR2 P21452 6/20 0.72
CYP1A2 P05177 2/20 0.70
CYP3A4 P08684 2/20 0.70
CYP2C9 P11712 2/20 0.70
CYP2C19 P33261 2/20 0.70
CYP2D6 P10635 1/20 0.70
TACR1 P25103 1/20 0.70
OPRM1 P35372 1/20 0.70
MEN1 O00255 1/20 0.70
ALDH1A1 P00352 1/20 0.70
TP53 P04637 1/20 0.70
TSHR P16473 1/20 0.70
NFKB1 P19838 1/20 0.70
MAPK1 P28482 1/20 0.70
BLM P54132 1/20 0.70
PMP22 Q01453 1/20 0.70
KMT2A Q03164 1/20 0.70
ATM Q13315 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Pavinetant SCHEMBL3587478 1.00 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
Pavinetant SCHEMBL17132260 1.00 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL3590211 0.88 TACR3 (0.79) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL4665567 0.88 TACR3 (0.79) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL18407125 0.87 TACR3 (0.80) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL4472992 0.85 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL1582141 0.85 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL4472989 0.85 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL1580864 0.85 TACR3 (1.00) TACR3TACR2CYP1A2CYP3A4CYP2C9
SCHEMBL12049917 0.85 TACR3 (0.78) TACR3TACR2CYP1A2CYP3A4CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3704271-B1 NEUROKININ ANTAGONISTS AND USES THEREOF CALIFORNIA INST OF TECHN (US) 2026-01-28 EP claimed
US-20250270330-A1 TREATMENT OF HEADACHE DISORDERS WITH NK3 MODULATORS KALLYOPE, INC. 2025-08-28 US claimed
US-20250262206-A1 USE OF TACHYKININ RECEPTOR 3 INHIBITÓR WUHAN UNIVERSITY (CN) 2025-08-21 US claimed
US-20250186427-A1 METHODS AND COMPOSITIONS FOR TREATING VASOMOTOR SYMPTOMS UNIVERSITY OF WASHINGTON 2025-06-12 US claimed
EP-4514351-A1 TREATMENT OF HEADACHE DISORDERS WITH NK3 MODULATORS Kallyope, Inc. (US) 2025-03-05 EP claimed
US-20250057830-A1 NEUROKININ ANTAGONISTS AND USES THEREOF CALIFORNIA INST OF TECHN (US) 2025-02-20 US claimed
US-12102653-B2 Ligand regulated protein-protein interaction system ST. ANNA KINDERKREBSFORSCHUNG (AT) 2024-10-01 US claimed
US-12083109-B2 Neurokinin antagonists and uses thereof CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2024-09-10 US claimed
US-20240252484-A1 Methods and Compositions for Treating Vasomotor Symptoms UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION 2024-08-01 US claimed
CN-118206634-A Ligand-regulated protein-protein interaction system 圣安娜儿童癌症研究中心 2024-06-18 CN claimed
US-20230338355-A1 NK ANTAGONISTS FOR CONTRACEPTION ACER THERAPEUTICS INC. 2023-10-26 US claimed
US-20230277518-A1 NK RECEPTOR ANTAGONISTS FOR CANCER PATIENTS ACER THERAPEUTICS INC. 2023-09-07 US claimed
WO-2023147134-A2 METHODS FOR TREATING PATIENTS HAVING LOW ESTROGEN WITH NK3 ANTAGONISTS ACER THERAPEUTICS, INC. (US) 2023-08-03 WO claimed
WO-2023147135-A1 NK RECEPTOR ANTAGONISTS FOR TREATMENT OF PROSTATE CANCER ACER THERAPEUTICS, INC. (US) 2023-08-03 WO claimed
EP-3041509-B1 NKR3 ANTAGONISTS FOR TREATING OR PREVENTING HOT FLUSHES IMPERIAL COLLEGE INNOVATIONS LTD (GB) 2023-07-12 EP claimed
US-20230128029-A1 NEUROKININ ANTAGONISTS AND USES THEREOF CALIFORNIA INSTITUTE OF TECHNOLOGY 2023-04-27 US claimed
US-11458129-B2 Neurokinin antagonists and uses thereof CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2022-10-04 US claimed
US-20220125781-A1 Methods and Compositions for Treating Vasomotor Symptoms UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION 2022-04-28 US claimed
WO-2022026901-A2 NK ANTAGONISTS FOR CONTRACEPTION ACER THERAPEUTICS INC. (US) 2022-02-03 WO claimed
WO-2022026900-A2 NK RECEPTOR ANTAGONISTS FOR CANCER PATIENTS ACER THERAPEUTICS INC. (US) 2022-02-03 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240252484-A1 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A TACR3 487/4885TACR2 179/4885CYP1A2 1621/4885
US-20230277518-A1 NK RECEPTOR ANTAGONISTS FOR CANCER PATIENTS BDKRB2, KLKB1, BDKRB1 TACR3 25/4885TACR2 5/4885CYP1A2 2972/4885
US-20230128029-A1 NEUROKININ ANTAGONISTS AND USES THEREOF CRH, NTSR2, TACR2 TACR3 65/4885TACR2 3/4885CYP1A2 4332/4885
US-20250186427-A1 METHODS AND COMPOSITIONS FOR TREATING VASOMOTOR SYMPTOMS VASP, PDE3A, PDE2A TACR3 487/4885TACR2 179/4885CYP1A2 1621/4885
US-20250057830-A1 NEUROKININ ANTAGONISTS AND USES THEREOF CRH, NTSR2, TACR2 TACR3 65/4885TACR2 3/4885CYP1A2 4332/4885
US-11458129-B2 Neurokinin antagonists and uses thereof CRH, NTSR2, TACR2 TACR3 65/4885TACR2 3/4885CYP1A2 4332/4885
US-20250262206-A1 USE OF TACHYKININ RECEPTOR 3 INHIBITÓR TAC3, TACR1, TACR2 TACR3 4/4885TACR2 3/4885CYP1A2 2766/4885
US-20220125781-A1 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A TACR3 487/4885TACR2 179/4885CYP1A2 1621/4885
US-12083109-B2 Neurokinin antagonists and uses thereof CRH, NTSR2, TACR2 TACR3 65/4885TACR2 3/4885CYP1A2 4332/4885
US-20230338355-A1 NK ANTAGONISTS FOR CONTRACEPTION KLKB1, KLK3, SHBG TACR3 42/4885TACR2 5/4885CYP1A2 873/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.