SCHEMBL9628751

SCHEMBL9628751

CCC(=O)Oc1c(OC)cc(OC)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ATM Q13315 3/20 0.42
HTT P42858 1/20 0.42
HPGDS O60760 1/20 0.41
ALOX15 P16050 1/20 0.41
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 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
HSD17B10 Q99714 1/20 0.40
LMNA P02545 3/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
PKM P14618 1/20 0.40
ELANE P08246 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
SCHEMBL9628154 0.95 HTT (0.44) MEN1KMT2AATMHTTHPGDS
SCHEMBL9629368 0.89 HTT (0.44) MEN1KMT2AHTTHPGDSALOX15
SCHEMBL9659842 0.89 CNR1 (0.42) MEN1KMT2AHTTALDH1A1L3MBTL1
SCHEMBL9627505 0.88 EP300 (0.50) MEN1KMT2AHTTALDH1A1L3MBTL1
SCHEMBL9627564 0.85 ALOX15 (0.43) MEN1KMT2AHTTHPGDSALOX15
SCHEMBL9628328 0.84 TOP2A (0.46) MEN1KMT2AALOX15ALDH1A1CYP1A2
SCHEMBL9628298 0.84 SMN1; SMN2 (0.54) MEN1KMT2AATMALDH1A1L3MBTL1
SCHEMBL9627936 0.83 ALDH1A1 (0.43) MEN1KMT2AHTTALDH1A1L3MBTL1
SCHEMBL9627605 0.83 SLC2A1 (0.44) HTTL3MBTL1CYP3A4KDM4EMAPT
SCHEMBL9627466 0.82 HTT (0.61) MEN1KMT2AHTTALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US claimed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP claimed
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-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282056-A2 Naphthalene 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