SCHEMBL6307980

SCHEMBL6307980

CCCCCCCCOc1ccc(Cn2c(C)nc3ccc(C(=O)OCC)cc32)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.55
▸ PDE2A O00408 2/20 0.41
▸ PDE10A Q9Y233 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ GALR3 O60755 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SIRT2 Q8IXJ6 5/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ THRB P10828 2/20 0.40
▸ ALOX5AP P20292 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ NLRP3 Q96P20 1/20 0.39
▸ THRA P10827 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.38
▸ SIRT3 Q9NTG7 1/20 0.38

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
SCHEMBL6304029 1.00 PPARG (0.55) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6308646 0.99 PPARG (0.56) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6301191 0.97 PPARG (0.55) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6301570 0.94 PPARG (0.51) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6308005 0.92 PPARG (0.57) PPARGTSHR
SCHEMBL6303646 0.92 PPARG (0.57) PPARGTSHR
SCHEMBL6301607 0.91 PPARG (0.58) PPARGTSHR
SCHEMBL7657817 0.91 PPARG (0.51) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6394789 0.90 PPARG (0.49) PPARGPDE2APDE10AMAPTRAB9A
SCHEMBL6303584 0.90 PPARG (0.56) PPARGTSHRALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869950-B1 Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-03-22 — — US disclosed
EP-1142880-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 — — EP disclosed
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