SCHEMBL7396279

SCHEMBL7396279

Cc1ccc(S(=O)(=O)NCCc2ccc(NC(=O)C3CCN(c4ccncc4)CC3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
ALDH1A1 P00352 6/20 0.55
THRB P10828 1/20 0.53
F10 P00742 6/20 0.53
HTR1A P08908 1/20 0.51
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NAMPT P43490 1/20 0.48
ITGB3 P05106 1/20 0.48
ITGA2B P08514 1/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
PPARG P37231 1/20 0.48
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL7400450 0.87 F10 (0.57) POLBF10MEN1KMT2ALMNA
SCHEMBL7403005 0.79 F10 (0.57) F10MEN1KMT2A
SCHEMBL7399741 0.78 F10 (0.63) F10LMNATP53MAPT
SCHEMBL7399688 0.78 ALDH1A1 (0.57) ALDH1A1HTR1AMEN1KMT2ALMNA
SCHEMBL9409519 0.77 F10 (0.59) F10LMNATP53MAPT
Hydrochloric Acid SCHEMBL9409439 0.76 F10 (0.61) F10LMNATP53MAPT
SCHEMBL7402740 0.76 F10 (0.54) F10NAMPTLMNATP53MAPT
SCHEMBL7406788 0.76 F10 (0.62) F10
SCHEMBL7392845 0.75 F10 (0.59) F10KMT2A
Hydrochloric Acid SCHEMBL7399543 0.75 F10 (0.61) F10

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
EP-0690847-A1 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1996-01-10 EP disclosed
WO-1994022835-A2 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed