SCHEMBL3582732

SCHEMBL3582732

Cc1cc(Br)cc2cccnc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.55
CCR8 P51685 5/20 0.55
CCR5 P51681 3/20 0.49
NQO2 P16083 1/20 0.49
PSMD14 O00487 1/20 0.49
COPS5 Q92905 1/20 0.49
PRMT5 O14744 1/20 0.47
LMNA P02545 2/20 0.47
DYRK1A Q13627 1/20 0.46
HTT P42858 2/20 0.45
HSP90AA1 P07900 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GMNN O75496 1/20 0.45
TP53 P04637 1/20 0.45
MMP2 P08253 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 1/20 0.45
MMP9 P14780 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL874272 0.80 PSMD14 (0.67) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL12093369 0.78 CCR1 (0.56) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL12847065 0.78 CCR1 (0.51) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL3347624 0.77 KDM4E (0.57) CCR1CCR8CCR5LMNAHTT
SCHEMBL2938512 0.77 LMNA (0.56) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL19001540 0.77 CCR1 (0.55) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL5544307 0.77 CCR1 (0.55) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL5544300 0.77 CCR1 (0.55) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL17092795 0.77 CCR1 (0.55) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL1148955 0.77 CCR1 (0.45) CCR1CCR8CCR5PSMD14COPS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116253681-A Synthesis method of 6-amino-8-difluoromethyl quinoline 苏州康润医药有限公司 2023-06-13 CN claimed
US-12448392-B2 Spiropiperidine derivatives CEPHALON LLC (US) 2025-10-21 US disclosed
EP-4562017-A1 NOVEL ACC INHIBITORS Pfizer Inc. (US) 2025-06-04 EP disclosed
CN-120019059-A Novel ACC inhibitors 辉瑞公司 2025-05-16 CN disclosed
EP-4055014-B1 PYRROLIDINE AND PIPERIDINE COMPOUNDS YUHAN CORP (KR) 2025-04-30 EP disclosed
US-20240391940-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME GENEROS BIOPHARMA LTD. (GB) 2024-11-28 US disclosed
CN-114867719-B Pyrrolidine and piperidine compounds 柳韩洋行 2024-06-25 CN disclosed
US-20240166661-A1 Spiropiperidine Derivatives CEPHALON LLC 2024-05-23 US disclosed
US-20240109915-A1 NOVEL ACC INHIBITORS PFIZER INC. (US) 2024-04-04 US disclosed
WO-2024023727-A1 NOVEL ACC INHIBITORS PFIZER INC. (US) 2024-02-01 WO disclosed
US-7491722-B2 Pyridazin-3(2H)-one derivatives LABORATORIOS ALMIRALL S.A. (ES) 2009-02-17 US disclosed
US-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 US disclosed
US-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 US disclosed
US-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 US disclosed
WO-2009009633-A1 SUBSTITUTED HETEROCYCLIC ETHERS AND THEIR USE IN CNS DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-15 WO disclosed
WO-2009009633-A1 SUBSTITUTED HETEROCYCLIC ETHERS AND THEIR USE IN CNS DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-15 WO disclosed
WO-2008051805-A2 TRIAZOLO-PYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-05-02 WO disclosed
US-5523312-A ADMINISTERING TO MAMMALS STERLING WINTHROP INC. (US) 1996-06-04 US disclosed
US-5514692-A VIRICIDES STERLING WINTHROP INC. (US) 1996-05-07 US disclosed
WO-1996009822-A1 ANTIPICORNAVIRAL AGENTS SANOFI WINTHROP, INC. (US) 1996-04-04 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 (5 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-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders CNR1, CNR2, PMP22 CCR1 736/4885CCR8 1009/4885CCR5 1343/4885
US-20240109915-A1 NOVEL ACC INHIBITORS CBR3, NAT1, ACACB CCR1 590/4885CCR8 994/4885CCR5 1565/4885
US-12448392-B2 Spiropiperidine derivatives FASN, FADS2, SCD5 CCR1 3705/4885CCR8 4323/4885CCR5 2775/4885
US-20240166661-A1 Spiropiperidine Derivatives FASN, FADS2, SCD5 CCR1 3705/4885CCR8 4323/4885CCR5 2775/4885
US-20240391940-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME STAT5A, STAT5B, JAK2 CCR1 2573/4885CCR8 1437/4885CCR5 1036/4885

“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.