SCHEMBL9685095

SCHEMBL9685095

Oc1ccc(-c2cccnn2)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
MAPT P10636 4/20 0.43
TYR P14679 2/20 0.43
CASP6 P55212 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
RUNX1 Q01196 1/20 0.41
CBFB Q13951 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL8138036 0.80 IDO1 (0.44) RAB9AMAPTCASP6ALDH1A1MEN1
SCHEMBL30717913 0.80 IDO1 (0.44) RAB9AMAPTCASP6ALDH1A1MEN1
SCHEMBL29942556 0.80 IDO1 (0.44) RAB9AMAPTCASP6ALDH1A1MEN1
Hydrochloric Acid SCHEMBL30595233 0.78 IDO1 (0.43) RAB9AMAPTCASP6ALDH1A1MEN1
SCHEMBL31729516 0.78 KMT2A (0.42) CASP6ALDH1A1KMT2APOLBKDM4E
SCHEMBL6677481 0.77 TYR (0.43) ALOX5NPC1RAB9AMAPTTYR
SCHEMBL6068182 0.74 KDM1A (0.54) ALOX5NPC1RAB9AMAPTTYR
SCHEMBL30900828 0.74 KDM1A (0.54) ALOX5NPC1RAB9AMAPTTYR
SCHEMBL8138043 0.74 MAPT (0.56) NPC1RAB9AMAPTALDH1A1MEN1
Hydrochloric Acid SCHEMBL6068111 0.73 KDM1A (0.53) ALOX5NPC1RAB9AMAPTTYR

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-0506615-A2 Stabilized methylmethacrylate polymers CIBA-GEIGY AG (CH) 1992-09-30 EP disclosed