SCHEMBL9628154

SCHEMBL9628154

CCC(=O)Oc1cc(OC)c(OC(=O)CC)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
FGFR1 P11362 1/20 0.41
VCP P55072 1/20 0.41
HPGDS O60760 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
STAT6 P42226 1/20 0.40
ACHE P22303 1/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
ATM Q13315 2/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL9628751 0.95 MEN1 (0.42) HTTL3MBTL1FGFR1VCPHPGDS
SCHEMBL9629368 0.94 HTT (0.44) HTTL3MBTL1FGFR1VCPHPGDS
SCHEMBL9627564 0.90 ALOX15 (0.43) HTTL3MBTL1HPGDSALOX15KMT2A
SCHEMBL9627936 0.88 ALDH1A1 (0.43) HTTL3MBTL1FGFR1VCPKMT2A
SCHEMBL9659842 0.88 CNR1 (0.42) HTTL3MBTL1KMT2AALDH1A1HSD17B10
SCHEMBL9627505 0.87 EP300 (0.50) HTTL3MBTL1FGFR1KMT2AALDH1A1
SCHEMBL9628333 0.87 HTT (0.43) HTTL3MBTL1ALOX15KMT2AALDH1A1
SCHEMBL10705564 0.85 HTT (0.42) HTTALOX15KMT2AALDH1A1HSD17B10
SCHEMBL9627534 0.85 L3MBTL1 (0.43) L3MBTL1FGFR1VCPHPGDSALOX15
SCHEMBL9627754 0.85 TOP2A (0.48) ALOX15KMT2AALDH1A1CYP1A2CYP3A4

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
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed