SCHEMBL11210171

SCHEMBL11210171

CCOC(=O)C1=C(c2ccccc2)CC=N1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
RAB9A P51151 3/20 0.48
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 2/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
CHRM5 P08912 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
ADORA3 P0DMS8 2/20 0.45
TSHR P16473 1/20 0.45
CDC7 O00311 2/20 0.44
DBF4 Q9UBU7 2/20 0.44
TRPM8 Q7Z2W7 1/20 0.44

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
SCHEMBL11215574 0.84 CHRM2 (0.53) ALDH1A1LMNAMAPTRAB9AKDM4E
SCHEMBL11220646 0.74 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL6885396 0.71 MAPT (0.38) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL16061721 0.70 SLC6A3 (0.64) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL23951707 0.69 SLC6A2 (0.56) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL1752640 0.69 SLC6A2 (0.67) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7306231 0.69 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL8396205 0.69 KDM4E (0.49) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL7300958 0.69 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAMAPTRAB9A
SCHEMBL1752641 0.69 SLC6A2 (0.67) CHRM2CHRM4CHRM5CHRM1CHRM3

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