SCHEMBL1922455

SCHEMBL1922455

Cc1ccc(B(O)O)c(Cl)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.37
RAB9A P51151 1/20 0.37
CCR5 P51681 1/20 0.37
MAPT P10636 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EGFR P00533 4/20 0.35
POLB P06746 1/20 0.34
KDM4E B2RXH2 2/20 0.33
METAP2 P50579 1/20 0.32
CYP1A2 P05177 2/20 0.32
DHODH Q02127 1/20 0.32
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL17975140 0.82 CCR1 (0.37) CCR1RAB9ACCR5MAPTALDH1A1
SCHEMBL29367157 0.79 ENPP2 (0.32)
SCHEMBL1506336 0.79 ENPP2 (0.32)
SCHEMBL29952243 0.77 ENPP2 (0.31)
SCHEMBL489376 0.76 CCR1 (0.40) CCR1RAB9ACCR5MAPTALDH1A1
SCHEMBL30788696 0.76 CCR1 (0.40) CCR1RAB9ACCR5MAPTALDH1A1
SCHEMBL20580799 0.76 NOS2 (0.37) RAB9AMAPTKDM4EKMT2AHTT
SCHEMBL13260555 0.76 ENPP2 (0.30)
SCHEMBL29954275 0.74 KDM4E (0.39) CCR1RAB9ACCR5MAPTALDH1A1
SCHEMBL21156607 0.73 NOS3 (0.38) CCR1RAB9ACCR5MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326769-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT INC (US) 2025-10-23 US disclosed
US-12410183-B2 Sars-cov2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
EP-4605397-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS Nuvalent, Inc. (US) 2025-08-27 EP disclosed
CN-120035594-A Heteroaromatic macrocyclic ether chemotherapeutic agents 纽威伦特公司 2025-05-23 CN disclosed
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-02-06 US disclosed
US-12091420-B2 SARS-COV2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2024-09-17 US disclosed
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 US disclosed
US-20240217959-A1 New (Homo)Piperidinyl Heterocycles as Sigma Ligands ACONDICIONAMIENTO TARRASENSE (ES) 2024-07-04 US disclosed
WO-2024086634-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT, INC. (US) 2024-04-25 WO disclosed
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-04-11 US disclosed
EP-2176263-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS AstraZeneca AB (SE) 2010-04-21 EP disclosed
EP-2007750-A1 AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS GLAXO GROUP LIMITED (GB) 2008-12-31 EP disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 US disclosed
WO-2008155572-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS ASTRAZENECA AB (SE) 2008-12-24 WO disclosed
US-20070249642-A1 Azabicyclo[3.1.0]hex-3-yl}alkyl)pyrimidinedione GLAXO GROUP LIMITED (GB) 2007-10-25 US disclosed
WO-2007113232-A1 AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS GLAXO GROUP LIMITED (GB) 2007-10-11 WO disclosed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
US-7053079-B2 Dihydroxy (3-pyridyl) borane compounds KOEI CHEMICAL COMPANY, LIMITED (JP) 2006-05-30 US disclosed
US-20040254076-A1 Dihydroxy (3-pyridyl) borane compounds KOEI CHEMICAL COMPANY, LIMITED (JP) 2004-12-16 US disclosed
EP-1460079-A1 DIHYDROXY(3-PYRIDYL)BORANE COMPOUNDS Koei Chemical Co., Ltd. (JP) 2004-09-22 EP 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 (11 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-20250326769-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS ROS1, MCL1, ALK CCR1 708/4885RAB9A 1675/4885CCR5 3763/4885
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE CCR1 2906/4885RAB9A 2168/4885CCR5 2319/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE CCR1 2906/4885RAB9A 2168/4885CCR5 2319/4885
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE CCR1 2906/4885RAB9A 2168/4885CCR5 2319/4885
US-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF CCR1 4436/4885RAB9A 355/4885CCR5 4774/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE CCR1 2906/4885RAB9A 2168/4885CCR5 2319/4885
US-20040254076-A1 Dihydroxy (3-pyridyl) borane compounds CYP24A1, DRD3, HSD3B1 CCR1 394/4885RAB9A 445/4885CCR5 1733/4885
US-20070060573-A1 Acyltryptophanols FSHR, NPY1R, NPY2R CCR1 3506/4885RAB9A 2725/4885CCR5 1768/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE CCR1 2906/4885RAB9A 2168/4885CCR5 2319/4885
US-20070249642-A1 Azabicyclo[3.1.0]hex-3-yl}alkyl)pyrimidinedione AZI2, NT5C3B, CYP1B1 CCR1 1890/4885RAB9A 715/4885CCR5 334/4885
US-20240217959-A1 New (Homo)Piperidinyl Heterocycles as Sigma Ligands SIGMAR1, TMEM97, OPRD1 CCR1 1307/4885RAB9A 4270/4885CCR5 552/4885

“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.