SCHEMBL14732040

SCHEMBL14732040

CCC(=O)NC1CCC(Nc2cc(NC3CC3)c3ncc(C(=O)Nc4ccnc(Cl)c4)n3n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.49
▸ PDE4D Q08499 2/20 0.45
▸ TTK P33981 3/20 0.41
▸ STAT3 P40763 1/20 0.38
▸ ERN1 O75460 1/20 0.38

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
SCHEMBL13062262 1.00 TYK2 (0.49) TYK2PDE4DTTKSTAT3ERN1
SCHEMBL14732068 0.94 TYK2 (0.47) TYK2PDE4DTTK
SCHEMBL13062535 0.94 TYK2 (0.47) TYK2PDE4DTTK
SCHEMBL14732140 0.92 TYK2 (0.51) TYK2PDE4DTTKSTAT3
SCHEMBL13062287 0.92 TYK2 (0.51) TYK2PDE4DTTKSTAT3
SCHEMBL3778247 0.91 TYK2 (0.47) TYK2PDE4DTTKSTAT3ERN1
SCHEMBL3774320 0.91 TYK2 (0.47) TYK2PDE4DTTKSTAT3ERN1
SCHEMBL3774322 0.91 TYK2 (0.47) TYK2PDE4DTTKSTAT3ERN1
SCHEMBL3778250 0.91 TYK2 (0.47) TYK2PDE4DTTKSTAT3ERN1
SCHEMBL3821439 0.91 TYK2 (0.47) TYK2PDE4DTTKSTAT3ERN1

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-2240488-B1 SUBSTITUTED IMIDAZOPYRIDAZINES USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-11-02 — — EP claimed
US-8389527-B2 Substituted imidazopyridazines useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-03-05 — — US claimed
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