SCHEMBL9313441

SCHEMBL9313441

CSc1ncccc1C([NH])=O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
L3MBTL1 Q9Y468 5/20 0.54
RAB9A P51151 2/20 0.54
TSHR P16473 2/20 0.54
CASP3 P42574 2/20 0.54
SENP8 Q96LD8 2/20 0.54
SENP7 Q9BQF6 2/20 0.54
SENP6 Q9GZR1 2/20 0.54
NPC1 O15118 2/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 2/20 0.49
HTT P42858 1/20 0.49
GLA P06280 1/20 0.49

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
SCHEMBL8284968 0.83 KMT2A (0.62) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL355357 0.83 ALDH1A1 (0.59) KMT2AL3MBTL1RAB9ATSHRCASP3
Hydrochloric Acid SCHEMBL1375604 0.81 ALDH1A1 (0.62) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL934289 0.81 KMT2A (0.56) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL1327237 0.81 KMT2A (0.56) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL3077349 0.81 KMT2A (0.56) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL9314355 0.79 KMT2A (0.66) KMT2ARAB9ANPC1HPGDMEN1
SCHEMBL13610811 0.79 KMT2A (0.54) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL13623626 0.79 L3MBTL1 (0.55) KMT2AL3MBTL1RAB9ATSHRCASP3
SCHEMBL3717527 0.79 KMT2A (0.72) KMT2AL3MBTL1RAB9ATSHRCASP3

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
US-5286721-A Antimicrobial agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-15 US disclosed
WO-1992006978-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-30 WO disclosed