SCHEMBL10722683

SCHEMBL10722683

CCC/C=C/NC(=O)Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.50
▸ NPC1 O15118 5/20 0.50
▸ EPHX1 P07099 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ TP53 P04637 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ EPHX2 P34913 1/20 0.50
▸ CDK9 P50750 1/20 0.50
▸ CLK4 Q9HAZ1 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ HTT P42858 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ SOAT2 O75908 1/20 0.48
▸ SOAT1 P35610 1/20 0.48
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ NOX1 Q9Y5S8 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
SCHEMBL10722691 1.00 RAB9A (0.50) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL28774232 0.78 SMN1; SMN2 (0.59) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL8907266 0.77 PSMB11 (0.56) RAB9ANPC1ALDH1A1SMN1; SMN2CYP2C19
SCHEMBL14855370 0.73 SMN1; SMN2 (0.64) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL7908202 0.73 SMN1; SMN2 (0.64) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL9603838 0.73 KDM4E (0.44) RAB9ANPC1ALDH1A1SMN1; SMN2TSHR
SCHEMBL13669959 0.73 RAB9A (0.56) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL19398197 0.73 ALDH1A1 (0.79) RAB9ANPC1EPHX1ALDH1A1SMN1; SMN2
SCHEMBL1416252 0.73 TGM2 (0.53) EPHX1ALDH1A1SMN1; SMN2TP53TSHR
SCHEMBL2237461 0.72 SMN1; SMN2 (0.52) RAB9ANPC1ALDH1A1SMN1; SMN2HTT

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-4682193-A HEAT SENSITIVE, STORAGE STABILITY FUJI PHOTO FILM CO., LTD. (JP) 1987-07-21 — — US disclosed
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