SCHEMBL10401264

SCHEMBL10401264

C=CC(=O)NNC(=N)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 3/20 0.48
▸ AKT1 P31749 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ GSTO1 P78417 2/20 0.39
▸ CES1 P23141 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ DAO P14920 1/20 0.37
▸ TSHR P16473 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
SCHEMBL8840278 0.81 RAB9A (0.57) TGM2AKT1ALDH1A1CYP2C9HPGD
SCHEMBL5067711 0.79 F2 (0.50) ALDH1A1CYP3A4CYP2C19CES1HPGD
SCHEMBL2931801 0.71 AKT1 (0.54) TGM2AKT1ALDH1A1HPGDALOX15
SCHEMBL6687668 0.71 TGM2 (0.64) TGM2AKT1ALDH1A1CYP3A4TDP1
SCHEMBL31528720 0.70 ALDH1A1 (0.65) ALDH1A1CYP2C9CYP2C19HPGDKDM4E
SCHEMBL29111221 0.70 TGM2 (0.75) TGM2ALDH1A1CYP2C19TDP1KDM4E
SCHEMBL27653304 0.70 KMT2A (0.61) TGM2AKT1ALDH1A1CYP3A4CYP2C9
SCHEMBL25369963 0.69 TSHR (0.53) TGM2ALDH1A1CYP2C19MAPK1TDP1
SCHEMBL7904447 0.69 AKT1 (0.52) TGM2AKT1ALDH1A1CYP3A4CYP2C9
SCHEMBL28159745 0.69 KMT2A (0.59) TGM2AKT1ALDH1A1CYP3A4CYP2C9

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-4973554-A COMPLEXING WITH POLYMER OF ACRYLAMIDE AND N-ACRYLOYL-M-AMINO-BENZAMIDINE NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1990-11-27 — — US claimed
US-4973554-A COMPLEXING WITH POLYMER OF ACRYLAMIDE AND N-ACRYLOYL-M-AMINO-BENZAMIDINE NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1990-11-27 — — US disclosed
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