SCHEMBL8046926

SCHEMBL8046926

CCCOc1cccc(CC[O])c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.57
CYP2D6 P10635 6/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
DHFR P00374 1/20 0.48
MEP1B Q16820 1/20 0.47
KCNH2 Q12809 2/20 0.47
GGPS1 O95749 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46

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
SCHEMBL8053831 0.92 CYP2D6 (0.56) CYP2D6PPARGPPARAKCNH2GGPS1
SCHEMBL8045885 0.86 CHRM2 (0.59) CYP2D6CA1CA2CA7CA9
SCHEMBL6265743 0.86 KMT2A (0.56) KMT2ACYP2D6CA1CA2CA7
SCHEMBL10235885 0.84 KMT2A (0.54) KMT2ACYP2D6CA1CA2CA7
SCHEMBL1047449 0.83 TAAR1 (0.64) KMT2ACYP2D6CA1CA2CA7
SCHEMBL9166576 0.83 KMT2A (0.49) KMT2ACYP2D6CA1CA2CA7
SCHEMBL3811700 0.83 CYP4F2 (0.63) KMT2ACYP2D6CA1CA2CA7
SCHEMBL18427030 0.83 LMNA (0.53) KMT2ACYP2D6DHFRKCNH2
SCHEMBL7853630 0.83 KMT2A (0.49) KMT2ACYP2D6CA1CA2CA7
SCHEMBL9166584 0.83 DHFR (0.51) KMT2ACYP2D6CA1CA2CA7

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-6106999-A SENSITIVITY TO GENERAL-PURPOSE VISIBLE LIGHT LASER, SO THAT HIGH-SPEED SCANNING EXPOSURE IS POSSIBLE BY LASER, AND EXTREMELY FINE HIGH RESOLUTION CAN BE OBTAINED; CAN BE USED FOR COATING OR PRINTING UNDER SAFELIGHT IRRADIATING CONDITIONS MITSUI CHEMICALS (JP) 2000-08-22 US disclosed