SCHEMBL9685101

SCHEMBL9685101

Oc1ccc(-c2cnccn2)c(O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.47
MAPT P10636 3/20 0.47
NPC1 O15118 3/20 0.47
TYR P14679 2/20 0.43
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 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
CASP6 P55212 1/20 0.41
GAA P10253 1/20 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
ALOX5 P09917 1/20 0.39
MET P08581 1/20 0.39

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
SCHEMBL27604626 0.81 RAB9A (0.42) RAB9AMAPTNPC1KMT2AALDH1A1
SCHEMBL27795040 0.81 NPC1 (0.46) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL11886380 0.78 IDO1 (0.47) ALDH1A1CASP6HPGDALOX5APFEN1
SCHEMBL31681935 0.78 IDO1 (0.47) ALDH1A1CASP6HPGDALOX5APFEN1
SCHEMBL30900828 0.74 KDM1A (0.54) RAB9AMAPTNPC1TYRKMT2A
SCHEMBL6068182 0.74 KDM1A (0.54) RAB9AMAPTNPC1TYRKMT2A
SCHEMBL2645237 0.74 CYP2D6 (0.51) RAB9AMAPTNPC1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL6068111 0.73 KDM1A (0.53) RAB9AMAPTNPC1TYRKMT2A
SCHEMBL31729958 0.73 XDH (0.53) RAB9AMAPTKMT2AALDH1A1MEN1
SCHEMBL2643979 0.72 RAB9A (0.42) RAB9AKMT2AMET

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