SCHEMBL9728112

SCHEMBL9728112

CCN1CCC=C(c2nc(N)sc2Cl)C1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL9728716 0.90 CHRM2 (0.41)
SCHEMBL9728399 0.84 CHRM1 (0.35)
SCHEMBL9728521 0.83 MAPT (0.41) RAD52
SCHEMBL9728829 0.82 DRD4 (0.38)
SCHEMBL9728485 0.82 DRD2 (0.43)
SCHEMBL9728317 0.82 CHRM1 (0.55)
SCHEMBL9729054 0.81 RAD52 (0.40) RAD52RECQL
SCHEMBL9728494 0.75 CHRM2 (0.45)
SCHEMBL9451907 0.73 RECQL (0.40) RECQL
SCHEMBL7610951 0.73 CHRM1 (0.67)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5128340-A Thiazole derivatives AKZO N.V. (NL) 1992-07-07 US disclosed
EP-0372125-A1 Oxazole and thiazole derivatives AKZO N.V. (NL) 1990-06-13 EP disclosed
EP-0368384-A1 Thiazole derivatives AKZO N.V. (NL) 1990-05-16 EP disclosed