Nitrogen

Nitrogen

SCHEMBL28600833

COC(=O)c1cccs1.N#N

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.63
L3MBTL1 Q9Y468 3/20 0.63
DAO P14920 1/20 0.57
TSHR P16473 5/20 0.55
KDM4E B2RXH2 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
HDAC1 Q13547 1/20 0.53
MAPT P10636 1/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 1/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
MEN1 O00255 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL497126 0.96
SCHEMBL28738208 0.96 KMT2A (0.67) KMT2AL3MBTL1DAOTSHRKDM4E
SCHEMBL27612026 0.94 KMT2A (0.65) KMT2AL3MBTL1DAOTSHRKDM4E
Hydrochloric Acid SCHEMBL9046846 0.94 KMT2A (0.65) KMT2AL3MBTL1DAOTSHRKDM4E
Hydrochloric Acid SCHEMBL28316325 0.94 KMT2A (0.65) KMT2AL3MBTL1DAOTSHRKDM4E
SCHEMBL27982360 0.92 KMT2A (0.63) KMT2AL3MBTL1DAOTSHRKDM4E
Boric Acid SCHEMBL27820498 0.90 KMT2A (0.61) KMT2AL3MBTL1DAOTSHRKDM4E
SCHEMBL28179531 0.89 KMT2A (0.59) KMT2AL3MBTL1DAOTSHRKDM4E
SCHEMBL28277937 0.87 KMT2A (0.58) KMT2AL3MBTL1DAOTSHRKDM4E
SCHEMBL27513494 0.87 KMT2A (0.58) KMT2AL3MBTL1DAOTSHRKDM4E

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
CN-113024430-A Process for converting substituted arylamines to arylazomethylsulfones 天津师范大学 2021-06-25 CN disclosed