SCHEMBL700700

SCHEMBL700700

CCn1c(C(=O)O)cc2cc(Cl)ccc21

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 17/20 0.65
GPR35 Q9HC97 1/20 0.60
ABCB11 O95342 1/20 0.51
CCR9 P51686 2/20 0.50

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
SCHEMBL8687383 0.88 CCR2 (0.62) CCR2ABCB11CCR9
SCHEMBL4372812 0.85 CCR2 (0.60) CCR2ABCB11
SCHEMBL6964777 0.85 CCR2 (0.49) CCR2GPR35
SCHEMBL22003789 0.84 ACLY (0.51) CCR2GPR35
SCHEMBL9613337 0.83 GPR35 (0.62) CCR2GPR35CCR9
SCHEMBL1553069 0.83 GPR35 (0.67) CCR2GPR35ABCB11
SCHEMBL8689838 0.82 ALDH1A1 (0.54) CCR2
SCHEMBL7681730 0.82 TDP1 (0.61) CCR2ABCB11
SCHEMBL27658570 0.82 CCR2 (0.82) CCR2GPR35ABCB11CCR9
SCHEMBL4537478 0.81 CCR2 (0.81) CCR2GPR35ABCB11CCR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100145047-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MADRIGAL PHARMACEUTICALS, INC. 2010-06-10 US claimed
US-20240109894-A1 SYNTHESIS OF 3-({5-CHLORO-1-[3-(METHYLSULFONYL)PROPYL]-1H-INDOL-2-YL} METHYL)-1-(2,2,2-TRIFLUOROETHYL)-1,3-DIHYDRO-2H-IMIDAZO[4,5-C]PYRIDIN-2-ONE JOHNSON & JOHNSON (CHINA) INVESTMENT LTD. (CN) 2024-04-04 US disclosed
WO-2021083998-A1 SYNTHESIS OF 3-({5-CHLORO-1-[3-(METHYLSULFONYL)PROPYL]-1H-INDOL-2 YL} METHYL)-1-(2,2,2-TRIFLUOROETHYL)-1,3-DIHYDRO-2H-IMIDAZO[4,5-C]PYRIDIN-2-ONE Janssen Sciences Ireland Unlimited Company (IE) 2021-05-06 WO disclosed
US-20200157076-A1 ACLY INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2020-05-21 US disclosed
US-10577356-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2020-03-03 US disclosed
US-20190040045-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2019-02-07 US disclosed
US-10118914-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2018-11-06 US disclosed
EP-3131905-B1 SPIRO UREA COMPOUNDS AS RSV ANTIVIRAL COMPOUNDS JANSSEN SCIENCES IRELAND UC (IE) 2018-02-28 EP disclosed
US-9738652-B2 Spiro urea compounds as RSV antiviral compounds JANSSEN SCIENCES IRELAND UC (IE) 2017-08-22 US disclosed
US-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2017-06-15 US disclosed
WO-2010065310-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE VIA PHARMACEUTICALS, INC (US) 2010-06-10 WO disclosed
US-20090163444-A1 PHOSPHO-INDOLES AS HIV INHIBITORS IDENIX PHARMACEUTICALS LLC 2009-06-25 US disclosed
US-7534809-B2 Phospho-indoles as HIV inhibitors IDENIX PHARMACEUTICALS, INC. (US) 2009-05-19 US disclosed
EP-1799696-B1 PHOSPHOINDOLES AS HIV INHIBITORS IDENIX PHARMACEUTICALS INC (US) 2008-11-12 EP disclosed
EP-1961757-A1 Phosphoindoles as HIV inhibitors IDENIX Pharmaceuticals, Inc. (US) 2008-08-27 EP disclosed
EP-1799696-A2 PHOSPHOINDOLES AS HIV INHIBITORS IDENIX Pharmaceuticals, Inc. (US) 2007-06-27 EP disclosed
WO-2006054182-A2 PHOSPHOINDOLES AS HIV INHIBITORS IDENIX PHARMACEUTICALS, INC. (US) 2006-05-26 WO disclosed
US-20060074054-A1 Phospho-indoles as HIV inhibitors IDENIX PHARMACEUTICALS LLC 2006-04-06 US disclosed
US-5852046-A Benzo-fused heterocyclic compounds having a 5-membered ring processes for their preparation their use as medicaments their use as diagnostic agents and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1998-12-22 US disclosed
EP-0639573-A1 Benzocondensed five membered heterocycles, process of their preparation, their use as drug, as diagnostic means and pharmaceuticals containing it HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-22 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 (9 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-20200157076-A1 ACLY INHIBITORS AND USES THEREOF ACLY, ATP5ME, ATP5MG CCR2 4510/4885GPR35 3726/4885ABCB11 390/4885
US-20060074054-A1 Phospho-indoles as HIV inhibitors IDO1, PPP5C, INMT CCR2 2409/4885GPR35 3285/4885ABCB11 4033/4885
US-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM CNR1, CNR2, ARRB1 CCR2 81/4885GPR35 27/4885ABCB11 3181/4885
US-20240109894-A1 SYNTHESIS OF 3-({5-CHLORO-1-[3-(METHYLSULFONYL)PROPYL]-1H-INDOL-2-YL} METHYL)-1-(2,2,2-TRIFLUOROETHYL)-1,3-DIHYDRO-2H-IMIDAZO[4,5-C]PYRIDIN-2-ONE HTR3C, MECP2, CDK2 CCR2 501/4885GPR35 4320/4885ABCB11 4880/4885
US-20100145047-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT CCR2 4191/4885GPR35 1008/4885ABCB11 1453/4885
US-20090163444-A1 PHOSPHO-INDOLES AS HIV INHIBITORS IDO1, PPP5C, INMT CCR2 2409/4885GPR35 3285/4885ABCB11 4033/4885
US-10577356-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them CNR1, CNR2, ARRB1 CCR2 81/4885GPR35 27/4885ABCB11 3181/4885
US-10118914-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them CNR1, CNR2, ARRB1 CCR2 81/4885GPR35 27/4885ABCB11 3181/4885
US-20190040045-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM CNR1, CNR2, ARRB1 CCR2 81/4885GPR35 27/4885ABCB11 3181/4885

“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.