SCHEMBL11220650

SCHEMBL11220650

NC(=O)N1C=C(c2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
ALOX15 P16050 1/20 0.40
RAB9A P51151 1/20 0.40
SIGMAR1 Q99720 1/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.37
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 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
SCHEMBL11212933 0.80 HPGD (0.46) ALDH1A1SMN1; SMN2KMT2AMEN1SIGMAR1
SCHEMBL11210225 0.73 NPC1 (0.51) ALDH1A1SMN1; SMN2KMT2AMEN1NPC1
SCHEMBL12497620 0.68 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2KMT2ATSHRMEN1
SCHEMBL18194345 0.66 ALDH1A1 (0.37) ALDH1A1SIGMAR1MAOAMAOB
Biphenyl SCHEMBL473288 0.65 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2TSHRLMNAL3MBTL1
Biphenyl SCHEMBL335359 0.65 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2TSHRLMNAL3MBTL1
Biphenyl SCHEMBL4593266 0.65 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2TSHRLMNAL3MBTL1
Biphenyl SCHEMBL1952613 0.65 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2TSHRLMNAL3MBTL1
SCHEMBL9234149 0.64 PGR (0.50) ALDH1A1SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL28696957 0.64 CYP11B2 (0.39) ALDH1A1SMN1; SMN2LMNAHPGDBCAT2

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
EP-0022087-B1 STABILIZERS FOR THERMOPLASTS THAT CONTAIN CHLORINE CIBA-GEIGY AG (CH) 1983-11-23 EP claimed