SCHEMBL14095919

SCHEMBL14095919

N#Cc1ccc(-c2ccc(OC(=O)c3ccc(-c4ccc(O)cc4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.59
ALDH1A1 P00352 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
HIF1A Q16665 1/20 0.50
CA12 O43570 1/20 0.50
CA2 P00918 1/20 0.50
CA3 P07451 1/20 0.50
CA6 P23280 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
SENP1 Q9P0U3 1/20 0.49
F2 P00734 1/20 0.48
MMP2 P08253 2/20 0.48
PARP15 Q460N3 1/20 0.47
PARP10 Q53GL7 1/20 0.47
PARP2 Q9UGN5 1/20 0.47
DEGS1 O15121 1/20 0.47
POLB P06746 1/20 0.47
P4HB P07237 1/20 0.47

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
SCHEMBL13041595 1.00 MMP3 (0.59) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL5945234 1.00 MMP3 (0.59) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL8058586 0.95 CA2 (0.55) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL12766491 0.95 CA2 (0.55) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL14096160 0.95 CA2 (0.55) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL29038955 0.88 ALDH1A1 (0.58) ALDH1A1CYP1A2CYP2D6HIF1ACA2
SCHEMBL8496209 0.88 ALDH1A1 (0.58) ALDH1A1CYP1A2CYP2D6HIF1ACA2
SCHEMBL2895378 0.88 PARP10 (0.65) MMP3ALDH1A1CYP1A2CYP2D6HIF1A
SCHEMBL8917849 0.88 ALDH1A1 (0.56) ALDH1A1CYP1A2CYP2D6HIF1AF2
SCHEMBL16493478 0.88 ALDH1A1 (0.53) MMP3ALDH1A1CYP1A2CYP2D6HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427364-B2 Liquid crystal composition, liquid crystal element, and cross-linked siloxane polymer FUJIFILM CORPORATION (JP) 2008-09-23 US disclosed
US-20070007492-A1 Liquid crystal composition, liquid crystal element, and cross-linked siloxane polymer FUJI PHOTO FILM CO., LTD. (JP) 2007-01-11 US disclosed