SCHEMBL9714009

SCHEMBL9714009

CCCCC(=O)Oc1cc(OC)c(OC(=O)CCCC)c2ccc(OC)cc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
RECQL P46063 1/20 0.42
TOP2A P11388 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
MTNR1A P48039 2/20 0.39
MTNR1B P49286 1/20 0.39
FPR1 P21462 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX5 P09917 1/20 0.39
CNR1 P21554 2/20 0.39
CNR2 P34972 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
SCHEMBL9713991 0.85 ALOX15 (0.41) MAPTTP53TOP2AFPR1ALOX15
SCHEMBL9642136 0.84 TP53 (0.49) MAPTTP53KMT2AKDM4EMTNR1A
SCHEMBL9627754 0.82 TOP2A (0.48) KMT2AKDM4EMEN1RECQLTOP2A
SCHEMBL9713400 0.82 TOP2A (0.47) KMT2AMEN1TOP2AALOX15
SCHEMBL10704787 0.81 TOP2A (0.46) TOP2AALOX15
SCHEMBL9713270 0.81 TOP2A (0.47) KMT2AKDM4EMEN1RECQLTOP2A
SCHEMBL9642492 0.80 TP53 (0.46) MAPTTP53KMT2AKDM4EMTNR1A
SCHEMBL9643595 0.79 MAPT (0.45) MAPTTP53KDM4EMTNR1AMTNR1B
SCHEMBL9643375 0.79 MAPT (0.45) MAPTTP53KDM4EMTNR1AMTNR1B
SCHEMBL9627564 0.79 ALOX15 (0.43) MAPTKMT2AKDM4EMEN1RECQL

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