SCHEMBL7399745

SCHEMBL7399745

COC(=O)Cc1ccc(NC(=O)C2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.59
F2 P00734 3/20 0.56
ELANE P08246 1/20 0.56
GLA P06280 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54

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
Hydrochloric Acid SCHEMBL7332238 0.99 F10 (0.58) F10F2ELANEGLAALDH1A1
SCHEMBL9409519 0.89 F10 (0.59) F10F2ELANEGLAMAPT
SCHEMBL7392845 0.87 F10 (0.59) F10F2ELANEGLA
Hydrochloric Acid SCHEMBL7336365 0.86 F10 (0.58) F10F2ELANEGLA
SCHEMBL7399758 0.85 F10 (0.63) F10F2ELANE
SCHEMBL7406788 0.84 F10 (0.62) F10F2ELANEGLA
Hydrochloric Acid SCHEMBL7399543 0.83 F10 (0.61) F10F2ELANEGLA
SCHEMBL7399741 0.82 F10 (0.63) F10F2ELANEGLAMAPT
SCHEMBL7403005 0.81 F10 (0.57) F10F2ELANEGLA
Hydrochloric Acid SCHEMBL9409439 0.80 F10 (0.61) F10F2ELANEGLAMAPT

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