SCHEMBL1432977

SCHEMBL1432977

CCN1CCCC1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.49
▸ CTSL P07711 9/20 0.47
▸ CTSV O60911 8/20 0.47
▸ CTSS P25774 8/20 0.47
▸ CTSK P43235 4/20 0.47
▸ ADAM17 P78536 1/20 0.42
▸ ITGB1 P05556 1/20 0.41
▸ ITGA4 P13612 1/20 0.41
▸ P2RX7 Q99572 1/20 0.40
▸ CTSB P07858 3/20 0.39

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
SCHEMBL1432743 0.91 ALDH1A1 (0.39) F2ITGB1ITGA4CTSB
SCHEMBL1432409 0.91 CTSL (0.48) F2CTSLCTSVCTSSCTSK
SCHEMBL1432630 0.90 DPP4 (0.39) F2
SCHEMBL1431769 0.90 DPP4 (0.39) F2
SCHEMBL1432334 0.89 F2 (0.46) F2CTSLCTSVCTSSCTSK
SCHEMBL1433005 0.89 CTSV (0.47) F2CTSLCTSVCTSSCTSK
SCHEMBL1431973 0.86 MEN1 (0.47) F2ITGB1ITGA4
SCHEMBL1432980 0.86 MEN1 (0.47) F2ITGB1ITGA4
SCHEMBL1432037 0.84 TACR1 (0.47) F2ITGB1ITGA4
SCHEMBL1432083 0.84 TACR1 (0.47) F2ITGB1ITGA4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP disclosed
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