SCHEMBL9450311

SCHEMBL9450311

C[CH]CC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.41
TAAR1 Q96RJ0 1/20 0.39
KCNN4 O15554 4/20 0.38
MAPK1 P28482 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 3/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL1551156 0.78 TAAR1 (0.54) TAAR1KCNN4MAPK1MAPTKMT2A
SCHEMBL3176030 0.75 KIF11 (0.46) KIF11TAAR1KCNN4TSHRALDH1A1
SCHEMBL440368 0.75 KIF11 (0.41) KIF11TAAR1KCNN4KMT2ATSHR
SCHEMBL1862170 0.75 TSHR (0.55) KIF11TAAR1KCNN4MAPK1MAPT
SCHEMBL11743873 0.75 KCNN4 (0.39) KIF11TAAR1KCNN4MAPK1TSHR
SCHEMBL1971090 0.70 KCNN4 (0.48) KIF11TAAR1KCNN4MAPK1TSHR
SCHEMBL28873040 0.69 KIF11 (0.50) KIF11TAAR1KCNN4MAPK1TSHR
SCHEMBL1149158 0.69 KIF11 (0.64) KIF11TAAR1KCNN4TSHRALDH1A1
SCHEMBL11638632 0.69 ALDH1A1 (0.40) KIF11KCNN4MAPK1TSHRALDH1A1
SCHEMBL17914194 0.69 CHRM2 (0.44) KMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5176984-A With a cationic dye, photoinitiator THE MEAD CORPORATION (US) 1993-01-05 US disclosed