SCHEMBL9628378

SCHEMBL9628378

CCOc1c(CC(C)C)c(O)c2ccccc2c1OC(=O)CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 2/20 0.37
ALOX15 P16050 1/20 0.37
KDM4E B2RXH2 4/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CASP3 P42574 1/20 0.34
CASP7 P55210 1/20 0.34
CASP9 P55211 1/20 0.34
CFTR P13569 1/20 0.34
PTGER4 P35408 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ALOX12 P18054 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
ELANE P08246 1/20 0.33
AKR1B1 P15121 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL9627594 0.90 KMT2A (0.37) KMT2AALDH1A1ALOX15KDM4EHPGD
SCHEMBL9627864 0.87 ALDH1A1 (0.38) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9627427 0.85 ALDH1A1 (0.41) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9657775 0.82 CFTR (0.40) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9629395 0.79 ALDH1A1 (0.39) KMT2AALDH1A1ALOX15KDM4EHPGD
SCHEMBL9628192 0.79 KDM4E (0.44) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9627977 0.77 ALDH1A1 (0.38) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9627063 0.76 ELANE (0.40) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9628689 0.75 PDE4A (0.47) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9642362 0.73 KDM4E (0.43) KMT2AALDH1A1KDM4EHPGDHSD17B10

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-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