SCHEMBL109671

SCHEMBL109671

NCc1ccc(F)cc1C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.65
MPO P05164 1/20 0.42
SLC6A2 P23975 7/20 0.41
SLC6A4 P31645 7/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SLC6A3 Q01959 1/20 0.40
DHFR P00374 1/20 0.40
P2RX7 Q99572 3/20 0.39
AGXT P21549 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38

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
SCHEMBL7782539 0.84 IDO1 (0.61) IDO1MPOSLC6A2SLC6A4HDAC3
SCHEMBL295918 0.83 IDO1 (0.50) IDO1MPOSLC6A2SLC6A4P2RX7
SCHEMBL1538597 0.83 IDO1 (0.63) IDO1SLC6A2SLC6A4HDAC3HDAC1
SCHEMBL179547 0.82 IDO1 (0.44) IDO1MPOSLC6A2SLC6A4P2RX7
SCHEMBL3278241 0.81 IDO1 (0.61) IDO1SLC6A2SLC6A4HDAC3HDAC1
SCHEMBL8417818 0.79 IDO1 (0.59) IDO1SLC6A2SLC6A4HDAC3HDAC1
SCHEMBL14647652 0.79 IDO1 (0.59) IDO1SLC6A2SLC6A4HDAC3HDAC1
SCHEMBL964552 0.79 DAO (0.46) IDO1
SCHEMBL147045 0.79 IDO1 (0.59) IDO1SLC6A2SLC6A4HDAC3HDAC1
SCHEMBL488748 0.79 IDO1 (0.59) IDO1SLC6A2SLC6A4HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119431706-A Fatigue-resistant polyurethane elastomer and preparation method and application thereof 万勋科技(深圳)有限公司 2025-02-14 CN claimed
US-11850555-B2 Dual-layer membrane and method for preparing same NANJING TECH UNIVERSITY (CN) 2023-12-26 US claimed
CN-113663536-B Double-layer polymer separation membrane and application thereof 南京工业大学 2022-11-08 CN claimed
CN-113663536-A Double-layer polymer separation membrane and application thereof 南京工业大学 2021-11-19 CN claimed
US-20210308627-A1 DUAL-LAYER MEMBRANE AND METHOD FOR PREPARING SAME NANJING TECH UNIVERSITY (CN) 2021-10-07 US claimed
CN-111790278-B Double-layer polymer separation membrane and preparation method thereof 南京工业大学 2021-03-02 CN claimed
CN-111790278-A Double-layer polymer separation membrane and preparation method thereof 南京工业大学 2020-10-20 CN claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 EP claimed
US-12545675-B2 Anti-wolbachia pyrido[2,3-d]pyrimidine compounds LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2026-02-10 US disclosed
WO-2025224085-A1 COMPOUNDS CAPABLE OF ACTING ON S1R AS WELL AS ON SEH AND USES THEREOF UNIVERSITAT DE BARCELONA (ES) 2025-10-30 WO disclosed
EP-4635568-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA Pharmaceuticals Inc. (US) 2025-10-22 EP disclosed
US-12435078-B2 Pyridazinones and methods of use thereof GFB (ABC), LLC (US) 2025-10-07 US disclosed
EP-4618985-A1 DUAL INHIBITORS OF SIGMA-1 RECEPTOR AND SOLUBLE EPOXIDE HYDROLASE AND THEIR USE IN THE TREATMENT OF PAIN Universitat De Barcelona (ES) 2025-09-24 EP disclosed
WO-2003045941-A1 PYRIDINE AND PYRIMIDINE DERIVATIVES CELLTECH R & D LIMITED (GB) 2003-06-05 WO disclosed
EP-1151990-A1 Substituted N-arylmethylamino derivatives of cyclobutene-3, 4-diones AMERICAN HOME PRODUCTS CORPORATION (US) 2001-11-07 EP disclosed
CN-1230173-A Substituted N-arylmethylamino derivatives of cyclobutene-3,-4-diones AMERICAN HOME PROD (US) 1999-09-29 CN disclosed
EP-0934257-A1 SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-08-11 EP disclosed
US-5780505-A ADMINISTERING AS SMOOTH MUSCLE RELAXANT AMERICAN HOME PRODUCTS CORPORATION (US) 1998-07-14 US disclosed
WO-1998002413-A1 SUBSTITUTED N-ARYLMETHYLAMINO DERIVATIVES OF CYCLOBUTENE-3,4-DIONES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-01-22 WO 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 (2 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-12545675-B2 Anti-wolbachia pyrido[2,3-d]pyrimidine compounds CBR1, CBR3, COX6C IDO1 3084/4885MPO 618/4885SLC6A2 2814/4885
US-12435078-B2 Pyridazinones and methods of use thereof PDXK, ATP6V1B1, REN IDO1 952/4885MPO 1968/4885SLC6A2 332/4885

“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.