SCHEMBL19980262

SCHEMBL19980262

CCCCc1cc(C#N)ccc1NC=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 1/20 0.38
▸ ABCC8 Q09428 1/20 0.38
▸ KCNJ11 Q14654 1/20 0.38
▸ KCNJ8 Q15842 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ DRD2 P14416 2/20 0.37
▸ DRD3 P35462 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MGLL Q99685 2/20 0.36
▸ TBXA2R P21731 4/20 0.35
▸ PANK3 Q9H999 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ KAT2B Q92831 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33

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
SCHEMBL7121445 0.86 ABCC9 (0.48) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL7398707 0.79 TSHR (0.40) TSHRHSD17B10DRD2DRD3MEN1
SCHEMBL22887810 0.79 CTRC (0.37) MEN1KMT2A
SCHEMBL10441821 0.74 TSHR (0.44) TSHRHSD17B10DRD2DRD3MEN1
SCHEMBL14390806 0.74 CYP3A4 (0.44) TSHR
SCHEMBL19597024 0.74 TSHR (0.41) TSHRHSD17B10DRD2DRD3MEN1
SCHEMBL4767252 0.73 TSHR (0.42) TSHRHSD17B10DRD2DRD3MEN1
SCHEMBL10465908 0.73 TYR (0.47) TSHRHSD17B10DRD2DRD3MEN1
SCHEMBL2693347 0.72 MEN1 (0.43) ABCC9ABCC8KCNJ11KCNJ8TSHR
SCHEMBL23287027 0.72 TYR (0.46) TSHRHSD17B10DRD2DRD3MEN1

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-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 — — EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 — — EP disclosed
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