SCHEMBL5099989

SCHEMBL5099989

O=Cc1cc(Sc2ccc(OCc3ccccc3)c(C=O)c2)ccc1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.51
CDK1 P06493 1/20 0.51
CDK4 P11802 1/20 0.51
CCNB1 P14635 1/20 0.51
CCND1 P24385 1/20 0.51
CCNB3 Q8WWL7 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MAPT P10636 1/20 0.48
GCK P35557 1/20 0.47
ERN1 O75460 2/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 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
SCHEMBL8154576 0.88 GCK (0.60) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL4030290 0.81 CCNB2 (0.54) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL3615463 0.81 MAOB (0.58) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL31312392 0.81 MAOA (0.58) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL324826 0.80 CCNB2 (0.56) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL16585825 0.80 MAPT (0.60) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL82269 0.80 PTGDR2 (0.61) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL1022461 0.80 CCNB2 (0.53) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL1119150 0.80 JAK2 (0.57) CCNB2CDK1CDK4CCNB1CCND1
SCHEMBL12952636 0.80 CCNB2 (0.56) CCNB2CDK1CDK4CCNB1CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381842-B2 Oxime ester photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-06-03 US disclosed
US-6949678-B2 Oxime ester photoinitiators CIBA SPECIALTY CHEMICALS CORP. (US) 2005-09-27 US disclosed
US-20050191567-A1 Oxime ester photoinitiators KUNIMOTO KAZUHIKO (JP) 2005-09-01 US disclosed
US-20010012596-A1 For resist applications; thermostability, storage stability CIBA SPECIALTY CHEMICALS CORP. 2001-08-09 US disclosed