SCHEMBL19490332

SCHEMBL19490332

Cc1ccc(C(=O)NCc2cccc(CNC(=O)c3ccc(C)c(C)c3)c2)cc1C

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.70
NPC1 O15118 1/20 0.63
ALDH1A1 P00352 3/20 0.62
HPGD P15428 2/20 0.62
KMT2A Q03164 2/20 0.59
RAB9A P51151 1/20 0.59
MMP13 P45452 3/20 0.56
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
ESR1 P03372 1/20 0.52
POLB P06746 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ROCK2 O75116 2/20 0.51
ROCK1 Q13464 2/20 0.51

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
SCHEMBL22580579 0.95 NR1H4 (0.65) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL13947259 0.90 NR1H4 (0.80) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL22580589 0.87 NR1H4 (0.59) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL22580646 0.84 MLYCD (0.57) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL20674818 0.84 NR1H4 (0.55) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL19286335 0.84 NR1H4 (0.80) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL19623369 0.83 ALDH1A1 (0.78) NR1H4ALDH1A1MMP13
SCHEMBL1316394 0.82 KMT2A (0.61) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL22745906 0.82 NR1H4 (0.53) NR1H4NPC1ALDH1A1HPGDKMT2A
SCHEMBL22580650 0.81 NR1H4 (0.67) NR1H4NPC1ALDH1A1HPGDKMT2A

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-20170299965-A1 RESIN COMPOSITION, METHOD FOR PRODUCING HEAT-RESISTANT RESIN FILM, AND DISPLAY DEVICE TORAY INDUSTRIES, INC. (JP) 2017-10-19 US disclosed