SCHEMBL17306100

SCHEMBL17306100

CC(C)Oc1ccc(C(=O)c2ccc(Oc3ccc(-c4ccc(C(C)C)cc4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACACB O00763 10/20 0.59
ACACA Q13085 8/20 0.59
KMT2A Q03164 1/20 0.51
PARP10 Q53GL7 1/20 0.50
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
MCL1 Q07820 3/20 0.46
BCL2 P10415 1/20 0.46
MDM2 Q00987 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
SRD5A2 P31213 1/20 0.42
ELANE P08246 1/20 0.42

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
SCHEMBL17306109 0.95 KMT2A (0.56) ACACBACACAKMT2APARP10CNR1
SCHEMBL19346956 0.91 KMT2A (0.61) ACACBACACAKMT2APARP10CNR1
SCHEMBL20384137 0.87 ACACB (0.59) ACACBACACAKMT2APARP10MCL1
SCHEMBL25819341 0.87 ACACB (0.54) ACACBACACAKMT2APARP10CNR1
SCHEMBL194410 0.87 ACACB (0.54) ACACBACACAKMT2APARP10CNR1
SCHEMBL17306110 0.86 KMT2A (0.46) ACACBACACAKMT2APARP10CNR1
SCHEMBL12608150 0.86 KMT2A (0.46) ACACBACACAKMT2APARP10CNR1
SCHEMBL17306107 0.86 KMT2A (0.46) ACACBACACAKMT2APARP10CNR1
SCHEMBL18715510 0.82 ACACB (0.51) ACACBACACAKMT2APARP10CNR2
SCHEMBL2517350 0.82 KMT2A (0.73) KMT2APARP10MCL1SRD5A2ELANE

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-9765176-B2 Poly(ether ketone) polymers comprising cycloaliphatic units SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2017-09-19 US disclosed
US-20150344610-A1 POLY(ETHER KETONE) POLYMERS COMPRISING CYCLOALIPHATIC UNITS SOLVAY SPECIALITY POLYMERS USA, LLC 2015-12-03 US disclosed