SCHEMBL9642971

SCHEMBL9642971

CCCCC(=O)Oc1c(OC)c(OC)c(OC(=O)c2ccccc2Cl)c2cc(OC)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
KMT2A Q03164 5/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RECQL P46063 1/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 2/20 0.40
CLK1 P49759 1/20 0.39
ABCB11 O95342 1/20 0.39
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 2/20 0.38
ESR1 P03372 1/20 0.38
PKM P14618 1/20 0.38
ESR2 Q92731 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 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
SCHEMBL9642163 1.00 L3MBTL1 (0.46) L3MBTL1CNR1CNR2KMT2AMEN1
SCHEMBL9642136 0.86 TP53 (0.49) KMT2AKDM4EMAPTTP53ABCB11
SCHEMBL9643375 0.80 MAPT (0.45) L3MBTL1KDM4EMAPTTP53ABCB11
SCHEMBL9643595 0.80 MAPT (0.45) L3MBTL1KDM4EMAPTTP53ABCB11
SCHEMBL9642492 0.79 TP53 (0.46) KMT2AKDM4EMAPTTP53ABCB11
SCHEMBL9642932 0.79 TP53 (0.46) KMT2AKDM4EMAPTTP53ABCB11
SCHEMBL9643412 0.74 ABCB11 (0.50) KMT2AMEN1MAPTABCB11ESR1
SCHEMBL9643394 0.74 ABCB11 (0.50) KMT2AMEN1MAPTABCB11ESR1
SCHEMBL9642621 0.73 ABCB11 (0.48) KMT2AKDM4ERECQLABCB11ALDH1A1
SCHEMBL9642233 0.73 ABCB11 (0.60) MAPTABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed