SCHEMBL1011368

SCHEMBL1011368

CC(C)COCO.Nc1nc(N)nc(N)n1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
CCNA2 P20248 2/20 0.37
CDK2 P24941 2/20 0.37
CCNA1 P78396 2/20 0.37
LMNA P02545 2/20 0.32
TLR8 Q9NR97 1/20 0.31
ADORA2A P29274 1/20 0.30
CYP1A2 P05177 1/20 0.30
CASP1 P29466 1/20 0.30
PRKD3 O94806 1/20 0.30
MAPK8 P45983 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
SCHEMBL7132699 0.86 CDK1 (0.41) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL1160768 0.81
Formaldehyde SCHEMBL27708075 0.80 CDK1 (0.38) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL7561519 0.78 CASP1 (0.39) LMNACYP1A2CASP1
Ammonia Solution, Strong SCHEMBL28964187 0.78
Isobutanol SCHEMBL11126122 0.76 TSHR (0.53) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL9014232 0.75 LMNA (0.36) LMNACYP1A2CASP1
SCHEMBL16852158 0.74 CDK1 (0.44) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL7108420 0.72 HTR7 (0.33) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL16852155 0.71 CDK1 (0.49) CDK1CCNB1CCNA2CDK2CCNA1

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
EP-1482014-B1 Coating film formation process and coated article HONDA MOTOR CO LTD (JP) 2011-01-05 EP disclosed
US-20040241450-A1 Coating film formation process and coated article HONDA MOTOR CO., LTD. 2004-12-02 US disclosed
EP-1482014-A1 Coating film formation process and coated article HONDA MOTOR CO., Ltd. (JP) 2004-12-01 EP disclosed