SCHEMBL13899583

SCHEMBL13899583

COc1ccc2c(c1)c(N)nn2C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HPGD P15428 3/20 0.47
HTT P42858 3/20 0.47
HSD17B10 Q99714 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SCN9A Q15858 1/20 0.46
KDR P35968 1/20 0.46
ADRB2 P07550 1/20 0.44
GAA P10253 3/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
TNF P01375 1/20 0.42
HTR3A P46098 1/20 0.42
THRB P10828 2/20 0.42
CYP3A4 P08684 1/20 0.42
MAOA P21397 1/20 0.41

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
SCHEMBL13899522 0.86 KDR (0.59) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL13202490 0.81 ADORA2A (0.55) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL29923672 0.79 ALDH1A1 (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL14737989 0.79 ALDH1A1 (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL2320642 0.79 ALDH1A1 (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20389037 0.79 NAMPT (0.52) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL3655093 0.78 PRKCI (0.41) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL24915548 0.77 KDM4E (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL10271494 0.77 HSD17B10 (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL10221610 0.77 MAPT (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A

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
WO-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 WO disclosed
US-7511136-B2 Aminoindazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-03-31 US disclosed