SCHEMBL22473792

SCHEMBL22473792

CN[C@@H](C)c1ccc(-c2scnc2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
VHL P40337 12/20 0.47
ALDH1A1 P00352 1/20 0.37
NEK1 Q96PY6 5/20 0.34
P2RX3 P56373 1/20 0.34
P2RX2 Q9UBL9 1/20 0.34
ELOC Q15369 1/20 0.32
ELOB Q15370 1/20 0.32

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
SCHEMBL22526852 0.83 VHL (0.47) VHLP2RX3P2RX2ELOCELOB
SCHEMBL17947426 0.83 VHL (0.48) VHLALDH1A1P2RX3P2RX2
SCHEMBL21458942 0.82 VHL (0.52) VHLALDH1A1P2RX3P2RX2
SCHEMBL22955082 0.82 VHL (0.46) VHLP2RX3P2RX2ELOCELOB
SCHEMBL20425319 0.82 VHL (0.52) VHLALDH1A1P2RX3P2RX2
SCHEMBL19600903 0.82 VHL (0.46) VHLP2RX3P2RX2ELOCELOB
SCHEMBL24440245 0.81 VHL (0.47) VHLP2RX3P2RX2ELOCELOB
SCHEMBL24440260 0.81 VHL (0.47) VHLP2RX3P2RX2ELOCELOB
SCHEMBL22525599 0.81 VHL (0.58) VHL
SCHEMBL25906660 0.80 ALDH1A1 (0.34) VHLALDH1A1NEK1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024064328-A1 COMPOUNDS AND COMPOSITIONS AS SMARCA2/4 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-03-28 WO disclosed
WO-2023220425-A1 BCL-XL/BCL-2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-11-16 WO disclosed
US-20230312542-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-05 US disclosed
US-20230312542-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-05 US disclosed
US-11746120-B2 Stat degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
EP-4129402-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2023-02-08 EP disclosed
WO-2022100710-A1 TYROSINE KINASE 2 (TYK2) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN (SHANGHAI) , INC. (CN) 2022-05-19 WO disclosed
WO-2021252666-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-12-16 WO disclosed
WO-2021236695-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR MONTELINO THERAPEUTICS, INC. (US) 2021-11-25 WO disclosed
WO-2021222114-A1 BCL-2 PROTEIN INHIBITORS RECURIUM IP HOLDINGS, LLC (US) 2021-11-04 WO disclosed
WO-2020206424-A1 STAT DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-10-08 WO disclosed
US-10787443-B2 RAF-degrading conjugate compounds ZAMBONI CHEM SOLUTIONS INC. (CA) 2020-09-29 US disclosed

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

For each of this compound's patents that has machine-readable text (3 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-11746120-B2 Stat degraders and uses thereof STAT4, STAT1, STAT3 VHL 600/4885ALDH1A1 2465/4885NEK1 1875/4885
US-20230312542-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF VHL, MDM2, NEDD4 VHL 1/4885ALDH1A1 2395/4885NEK1 1151/4885
US-10787443-B2 RAF-degrading conjugate compounds BRAF, RAF1, ARAF VHL 11/4885ALDH1A1 273/4885NEK1 1323/4885

“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.