SCHEMBL9713700

SCHEMBL9713700

CC(C)COc1ccc2c(c1)C(=O)C=C(Cl)C2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.39
TRIM24 O15164 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MC4R P32245 1/20 0.38
PAX8 Q06710 1/20 0.38
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOB P27338 3/20 0.37
MAOA P21397 1/20 0.37
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL9627540 0.85 MAPT (0.49) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL9713690 0.81 IDO1 (0.51) PDK2TRIM24MAPTKDM4EALDH1A1
SCHEMBL9628296 0.80 PTPN1 (0.49) ALDH1A1MEN1KMT2A
SCHEMBL30003312 0.80 PTPN1 (0.49) ALDH1A1MEN1KMT2A
SCHEMBL9714006 0.75 MAOB (0.58) NPC1MAOBMAOAPPARGTOP1
SCHEMBL9714001 0.74 IGLV6-57 (0.45) BRD4CREBBP
SCHEMBL9642322 0.74 MAPT (0.48) PDK2TRIM24MAPTKDM4EALDH1A1
SCHEMBL10579406 0.73 PTPN1 (0.53) MAPTALDH1A1NPSR1MEN1KMT2A
SCHEMBL28455168 0.71 RAB9A (0.49) PDK2ALDH1A1NPSR1MEN1KMT2A
SCHEMBL9628351 0.71 LMNA (0.46) MAPTALDH1A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed