SCHEMBL7008246

SCHEMBL7008246

O=C(O)c1cc2ccccc2n1Cc1ccc(F)cc1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 13/20 0.81
PTGS1 P23219 2/20 0.58
PTGS2 P35354 2/20 0.58
GPR35 Q9HC97 1/20 0.58
PLA2G10 O15496 1/20 0.54
NOD2 Q9HC29 1/20 0.54
NOD1 Q9Y239 1/20 0.54
ALDH1A1 P00352 1/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL5378162 0.90 CCR2 (1.00) CCR2GPR35PLA2G10NOD2NOD1
SCHEMBL3961949 0.87 CCR2 (1.00) CCR2GPR35
SCHEMBL27811964 0.86 CCR2 (0.76) CCR2GPR35PLA2G10ALDH1A1CYP1A2
SCHEMBL6595461 0.86 CCR2 (0.73) CCR2GPR35PLA2G10
SCHEMBL29845455 0.86 CCR2 (0.81) CCR2GPR35PLA2G10NOD2NOD1
SCHEMBL6598061 0.85 CCR2 (0.79) CCR2
SCHEMBL6600760 0.85 CCR2 (0.79) CCR2
SCHEMBL4208025 0.85 CCR2 (0.74) CCR2GPR35
SCHEMBL7924294 0.84 CCR2 (0.58) CCR2PTGS1PTGS2PLA2G10NOD2
SCHEMBL7239402 0.84 CCR2 (0.69) CCR2PTGS1PTGS2GPR35

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
US-8846684-B2 Arbovirus inhibitors and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-09-30 US disclosed
US-8846684-B2 Arbovirus inhibitors and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-09-30 US disclosed
US-8846684-B2 Arbovirus inhibitors and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-09-30 US disclosed
WO-2012170098-A2 ARBOVIRUS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-12-13 WO disclosed
WO-2012170098-A2 ARBOVIRUS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-12-13 WO disclosed
US-20120252807-A1 ARBOVIRUS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
US-20120252807-A1 ARBOVIRUS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
US-20120252807-A1 ARBOVIRUS INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
EP-1322638-A1 ANTIFUNGAL AND/OR ANTIPARASITIC PHARMACEUTICAL COMPOSITION AND NOVEL INDOLE DERIVATIVES AS ACTIVE PRINCIPLE OF SUCH A COMPOSITION Yang Ji Chemical Company Ltd. (KR) 2003-07-02 EP disclosed
US-6528655-B1 Hydroxyphenyl diamido derivatives PHARMACOR, INC. (CA) 2003-03-04 US disclosed
WO-2002026697-A2 AROMATIC DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES PHARMACOR, INC. (CA) 2002-04-04 WO disclosed
WO-2002024685-A1 INDOLE DERIVATIVES AND THEIR USE AS ANTIFUNGAL AND/OR ANTIPARASITIC AGENTS YANG JI CHEMICAL COMPANY LTD. (KR) 2002-03-28 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 (1 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-20120252807-A1 ARBOVIRUS INHIBITORS AND USES THEREOF ACE, ACE2, MME CCR2 736/4885PTGS1 3541/4885PTGS2 3862/4885

“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.