SCHEMBL6287599

SCHEMBL6287599

CCNCC(C)(CNCC)CNC(N)=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.33
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6289594 0.83 SMN1; SMN2 (0.37) MCL1LMNAHSD17B10TDP1
SCHEMBL6285523 0.81 EPHX1 (0.37)
SCHEMBL6284420 0.81 MCL1 (0.34) MCL1TDP1
SCHEMBL6284424 0.79 MCL1 (0.33) MCL1
SCHEMBL6289593 0.78 TDP1 (0.32) TDP1
SCHEMBL6285506 0.78 HSD17B10 (0.31) HSD17B10
SCHEMBL6286463 0.78 MCL1 (0.32) MCL1
SCHEMBL6287640 0.76 TDP1 (0.33) TDP1
SCHEMBL74035 0.72
SCHEMBL2413071 0.72 SMN1; SMN2 (0.45) LMNAHSD17B10TDP1

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
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed