SCHEMBL10773489

SCHEMBL10773489

NS(=O)(=O)c1cc(C(=O)NN2CCN(c3ccccn3)CC2)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.56
▸ LMNA P02545 5/20 0.56
▸ HTT P42858 3/20 0.56
▸ CYP1A2 P05177 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ ALDH1A1 P00352 5/20 0.53
▸ KDM4E B2RXH2 4/20 0.52
▸ MAPT P10636 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ PKM P14618 1/20 0.50
▸ CA2 P00918 5/20 0.49
▸ CA9 Q16790 4/20 0.49
▸ CA1 P00915 4/20 0.49
▸ CA12 O43570 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ CA7 P43166 2/20 0.49
▸ CA3 P07451 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
SCHEMBL10518596 0.78 LMNA (0.58) SMN1; SMN2LMNAHTTALDH1A1KDM4E
SCHEMBL9352633 0.74 CA1 (0.58) SMN1; SMN2LMNAHTTCYP1A2CYP2C9
SCHEMBL8507747 0.72 ALDH1A1 (0.57) SMN1; SMN2CYP2C9NPSR1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL27510542 0.71 ALDH1A1 (0.53) SMN1; SMN2CYP2C9NPSR1ALDH1A1KDM4E
SCHEMBL7488520 0.71 ALDH1A1 (0.59) SMN1; SMN2CYP2C9NPSR1ALDH1A1KDM4E
SCHEMBL10401973 0.71 ALDH1A1 (0.56) SMN1; SMN2CYP2C9NPSR1ALDH1A1KDM4E
SCHEMBL9630198 0.70 CA1 (0.73) SMN1; SMN2LMNAHTTALDH1A1KDM4E
SCHEMBL19319241 0.69 SMN1; SMN2 (0.61) SMN1; SMN2LMNAHTTCYP1A2CYP2C9
Tripamide SCHEMBL49666 0.69 KDM4E (0.59) SMN1; SMN2LMNAHTTNPSR1ALDH1A1
Tripamide SCHEMBL1651231 0.69 KDM4E (0.59) SMN1; SMN2LMNAHTTNPSR1ALDH1A1

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-62255479-A — — None — — JP disclosed
JP-S62255479-A NOVEL SULFAMOYLBENZOIC ACID DERIVATIVE AND PRODUCTION THEREOF KYORIN PHARMACEUT CO LTD 1987-11-07 — — JP disclosed
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