SCHEMBL6063540

SCHEMBL6063540

COc1cc(F)c(Bc2c(F)c(F)c(F)c(OC)c2F)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.37
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
PKM P14618 2/20 0.31
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
TSHR P16473 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6062206 0.96 TAAR1 (0.39) TAAR1ALDH1A1CYP1A2CYP1A1CYP1B1
SCHEMBL6063174 0.88 MEN1 (0.31) MEN1KMT2A
SCHEMBL6062720 0.84 TAAR1 (0.38) TAAR1ALDH1A1CYP1A2CYP1A1CYP1B1
SCHEMBL6063190 0.84 MEN1 (0.31) MEN1KMT2A
SCHEMBL6063660 0.84 MEN1 (0.31) MEN1KMT2A
SCHEMBL6063885 0.84 MEN1 (0.32) MEN1KMT2A
SCHEMBL6063238 0.84 MEN1 (0.32) MEN1KMT2A
SCHEMBL5365010 0.83 HSD17B10 (0.32) MEN1KMT2A
SCHEMBL6062210 0.83 HSD17B10 (0.32) MEN1KMT2A
SCHEMBL5358129 0.83 TAAR1 (0.48) TAAR1ALDH1A1CYP1A2CYP1A1CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264320-A1 Hydrophobization and silica for supported catalyst RODRIGUEZ GEORGE 2006-11-23 US disclosed