SCHEMBL2331606

SCHEMBL2331606

OCCCCCCOc1ccc2nc(-c3ccccc3)n(-c3cccc(Cl)c3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.47
SRC P12931 1/20 0.47
MDM2 Q00987 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
PDE2A O00408 3/20 0.42
CYP1A2 P05177 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACSS2 Q9NR19 2/20 0.41
PDE10A Q9Y233 3/20 0.40
PPARG P37231 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40

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
SCHEMBL2326287 0.94 FGFR1 (0.47) FGFR1SRCMDM2SMN1; SMN2PDE2A
SCHEMBL2331041 0.91 FGFR1 (0.53) FGFR1SRCPDE2ACYP1A2ACSS2
SCHEMBL4588340 0.90 PPARG (0.46) MDM2SMN1; SMN2HTTPDE2APPARG
SCHEMBL2327086 0.90 FGFR1 (0.48) FGFR1SRCSMN1; SMN2PDE2ACYP1A2
SCHEMBL2327547 0.90 FGFR1 (0.46) FGFR1SRCSMN1; SMN2HTTPDE2A
SCHEMBL2327085 0.90 FGFR1 (0.54) FGFR1SRCPDE2ACYP1A2ACSS2
SCHEMBL2330825 0.89 TSHR (0.48) FGFR1SRCSMN1; SMN2PDE2ACYP1A2
SCHEMBL2323141 0.87 PDE3B (0.46) MDM2SMN1; SMN2HTTPDE2ANPC1
SCHEMBL2327812 0.86 ACSS2 (0.50) FGFR1SRCPDE2ACYP1A2ACSS2
SCHEMBL2334690 0.86 TSHR (0.49) FGFR1SRCPDE2ACYP1A2RAB9A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1246808-B1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION BAYER SCHERING PHARMA AG (DE) 2011-08-17 EP disclosed
US-7345075-B2 6-[(1,2-diphenyl-1H-benzimidazol-6-yl)oxy]hexanoic acid isopropyl ester; antiinflammatory agents; microglia activators; neurodegenerative diseases SCHERING AKTIENGESELLSCHAFT (DE) 2008-03-18 US disclosed
US-7329679-B2 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2008-02-12 US disclosed
US-7115645-B2 1,2 diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-10-03 US disclosed
US-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-14 US disclosed
US-20060094770-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-05-04 US disclosed
EP-1246808-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2002-10-09 EP disclosed
US-20020006948-A1 1,2 diarylbenzimdazoles and their pharmaceutical use SCHERING AG 2002-01-17 US disclosed
WO-2001051473-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2001-07-19 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 (3 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-20020006948-A1 1,2 diarylbenzimdazoles and their pharmaceutical use CYP2E1, CYP1B1, CYP1A1 FGFR1 1637/4885SRC 3271/4885MDM2 4485/4885
US-20060094770-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use ATP6V1B2, IL1B, GMFG FGFR1 1425/4885SRC 2424/4885MDM2 3467/4885
US-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use ATP6V1B2, IL1B, GMFG FGFR1 1425/4885SRC 2424/4885MDM2 3467/4885

“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.