SCHEMBL11402906

SCHEMBL11402906

Fc1cccc(N=Cc2ccc(F)c(F)c2F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ THPO P40225 1/20 0.38
▸ CHRM5 P08912 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ NFE2L2 Q16236 4/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ HSD17B10 Q99714 2/20 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
SCHEMBL11402904 1.00 MAPT (0.39) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11409848 0.88 CA1 (0.41) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11409846 0.88 CA1 (0.41) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11406101 0.83 NFE2L2 (0.50) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11406829 0.83 NFE2L2 (0.50) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11406827 0.83 NFE2L2 (0.50) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11406105 0.83 NFE2L2 (0.50) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11409599 0.82 MAPT (0.42) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11409601 0.82 MAPT (0.42) MAPTKDM4ENPC1RAB9ACYP1A2
SCHEMBL11403016 0.79 NFE2L2 (0.46) MAPTKDM4ENPC1RAB9ACYP1A2

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-4235929-A TOPICAL ADMINISTRATION OF ANTIINFLAMMATORY AGENT WILLIAM H. RORER, INC. (US) 1980-11-25 — — US disclosed
US-4230727-A N-BENZYLIDENEANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1980-10-28 — — US disclosed
US-4198349-A ANTIINFLAMMATORY, TOPICAL WILLIAM H. RORER, INC. (US) 1980-04-15 — — US disclosed
US-4187317-A Sunscreen and erythema treating with N-benzylidene anilenes WILLIAM H. RORER, INC. (US) 1980-02-05 — — US disclosed
US-4176198-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1979-11-27 — — US disclosed
Send feedback