SCHEMBL7260314

SCHEMBL7260314

CCCCCCSc1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.55
MAPT P10636 2/20 0.55
CYP1A2 P05177 3/20 0.50
CYP2E1 P05181 3/20 0.50
CYP3A4 P08684 3/20 0.50
CYP2C8 P10632 3/20 0.50
CYP2D6 P10635 3/20 0.50
CYP2C9 P11712 3/20 0.50
CYP2B6 P20813 3/20 0.50
CYP2C19 P33261 3/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
RYR2 Q92736 2/20 0.47
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL20495338 1.00 PTGES (0.55) PTGESMAPTCYP1A2CYP2E1CYP3A4
SCHEMBL5315774 1.00 PTGES (0.55) PTGESMAPTCYP1A2CYP2E1CYP3A4
SCHEMBL14838080 0.98 PTGES (0.52) PTGESMAPTCYP1A2CYP2E1CYP3A4
SCHEMBL423408 0.92 ALDH1A1 (0.51) PTGESMAPTCYP1A2CYP2E1CYP3A4
SCHEMBL5172139 0.92 ALDH1A1 (0.54) PTGESMAPTALDH1A1KDM4EMTNR1A
SCHEMBL5167250 0.90 ALDH1A1 (0.56) MAPTALDH1A1KDM4EMTNR1AMTNR1B
SCHEMBL2452199 0.88 THRA (0.54) PTGESMAPTALDH1A1MTNR1AMTNR1B
SCHEMBL8944110 0.87 ALDH1A1 (0.46) PTGESMAPTCYP1A2CYP2E1CYP3A4
SCHEMBL9808184 0.86 ALDH1A1 (0.56) MAPTCYP1A2ALDH1A1KDM4EMTNR1A
SCHEMBL21575599 0.86 THRB (0.56) THRATHRBMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688799-A1 CYCLOPENTADIENYL DERIVATIVES AND THEIR USES IN CATALYSIS Sigma-Aldrich Co., LLC (US) 2026-02-11 EP disclosed
WO-2024211095-A1 CYCLOPENTADIENYL DERIVATIVES AND THEIR USES IN CATALYSIS SIGMA-ALDRICH CO. LLC (US) 2024-10-10 WO disclosed
EP-3205640-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2017-08-16 EP disclosed
US-6652930-B2 Comprises mixture of compounds such as 1,2-bis(2-hydroxyethyl thio)ethane and homo/copolymers of diallylamine compounds such as polydiallylamine hydrochloride; phthalocyanine dye adds to stability; discoloration inhibition extends shelf-life OJI PAPER CO., LTD. (JP) 2003-11-25 US disclosed
US-20020071941-A1 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2002-06-13 US disclosed