SCHEMBL8935519

SCHEMBL8935519

ON1[CH]CCc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 2/20 0.41
USP2 O75604 1/20 0.41
CDK4 P11802 1/20 0.41
ALOX15 P16050 1/20 0.41
CCND1 P24385 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NOTUM Q6P988 2/20 0.40
TSHR P16473 2/20 0.39
HSD17B3 P37058 1/20 0.39
NPC1 O15118 1/20 0.39
MITF O75030 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
HPGD P15428 1/20 0.38
MAPT P10636 1/20 0.37
MGLL Q99685 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL1450910 0.74 MEN1 (0.45) SIGMAR1MEN1KMT2AALDH1A1USP2
SCHEMBL13826481 0.72 MEN1 (0.48) SIGMAR1MEN1KMT2AALDH1A1USP2
SCHEMBL1450281 0.71 ALDH1A1 (0.43) SIGMAR1MEN1KMT2AALDH1A1USP2
SCHEMBL1450289 0.71 NOTUM (0.54) MEN1KMT2AALDH1A1SMN1; SMN2NOTUM
SCHEMBL2157866 0.69 ALDH1A1 (0.41) MEN1KMT2AALDH1A1USP2CDK4
SCHEMBL6198490 0.69 HPGD (0.57) KMT2AALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL1408362 0.68 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AALDH1A1USP2
SCHEMBL29577468 0.68 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AALDH1A1USP2
SCHEMBL6199039 0.67 TSHR (0.45) MEN1KMT2AALDH1A1NOTUMTSHR
SCHEMBL6197328 0.67 ALDH1A1 (0.50) MEN1KMT2AALDH1A1USP2CDK4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8041006-A None JP disclosed
JP-H0841006-A DIUREA DERIVATIVE NISSHIN FLOUR MILLING CO LTD 1996-02-13 JP disclosed