SCHEMBL20299243

SCHEMBL20299243

NC(=O)c1sc(C2CCC2)nc1-c1ccccc1C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 4/20 0.54
▸ CDC7 O00311 2/20 0.53
▸ DBF4 Q9UBU7 2/20 0.53
▸ CCNE1 P24864 1/20 0.53
▸ CDK2 P24941 1/20 0.53
▸ CAMKK2 Q96RR4 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PARP1 P09874 1/20 0.38
▸ SCN9A Q15858 3/20 0.38
▸ LIMK1 P53667 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SCD5 Q86SK9 1/20 0.37
▸ SCD O00767 4/20 0.36
▸ ROCK2 O75116 1/20 0.36

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
SCHEMBL20298708 0.80 BTK (0.52) BTKCDC7DBF4CCNE1CDK2
SCHEMBL2488956 0.79 CDC7 (0.64) CDC7DBF4CCNE1CDK2PARP1
SCHEMBL4767842 0.70 BTK (1.00) BTKSCN9A
SCHEMBL27857887 0.70 CDC7 (0.53) CDC7DBF4CCNE1CDK2L3MBTL1
SCHEMBL11957358 0.69 BTK (0.98) BTKSCN9A
SCHEMBL8823085 0.68 BTK (0.48) BTKCDC7DBF4ALDH1A1
SCHEMBL952856 0.66 CDC7 (0.54) CDC7DBF4CCNE1CDK2PARP1
SCHEMBL21820809 0.66 MEN1 (0.48) BTKCCNE1CDK2ALDH1A1
SCHEMBL17766752 0.66 TRPV1 (0.53) BTK
SCHEMBL12153768 0.65 BTK (0.67) BTKLIMK1ALDH1A1ROCK2

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-3558956-A1 N-CYCLOBUTYL-THIAZOL-5-CARBOXAMIDES WITH NEMATICIDAL ACTIVITY Syngenta Participations AG (CH) 2019-10-30 — — EP disclosed
WO-2018114657-A1 N-CYCLOBUTYL-THIAZOL-5-CARBOXAMIDES WITH NEMATICIDAL ACTIVITY SYNGENTA PARTICIPATIONS AG (CH) 2018-06-28 — — WO disclosed
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