SCHEMBL28651309

SCHEMBL28651309

CC(C)(C)c1ccc(C(=O)O)cc1.CC(C)(C)c1ccc(C(=O)O)cc1.O[AlH2].[AlH3]

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.77
RARB P10826 1/20 0.69
RARG P13631 1/20 0.69
NR1H4 Q96RI1 3/20 0.65
EPHX2 P34913 2/20 0.65
RXRA P19793 4/20 0.58
RXRB P28702 4/20 0.58
RXRG P48443 1/20 0.58
CA1 P00915 2/20 0.57
NR4A2 P43354 1/20 0.57
CA2 P00918 1/20 0.57
TDP1 Q9NUW8 1/20 0.56
HDAC1 Q13547 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.53
MITF O75030 1/20 0.53
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53

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
SCHEMBL21523525 0.98 SRD5A2 (0.80) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL28061756 0.98 SRD5A2 (0.80) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL226824 0.96 SRD5A2 (0.83) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL5182151 0.96 SRD5A2 (0.83) SRD5A2RARBRARGNR1H4EPHX2
Water SCHEMBL2565838 0.93 SRD5A2 (0.80) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL29089107 0.93 SRD5A2 (0.80) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL36693 0.93 SRD5A2 (0.87) SRD5A2RARBRARGNR1H4EPHX2
SCHEMBL29033379 0.91 SRD5A2 (0.77) SRD5A2RARBRARGNR1H4EPHX2
Methane SCHEMBL10959139 0.91 SRD5A2 (0.83) SRD5A2RARBRARGNR1H4EPHX2
Hydrochloric Acid SCHEMBL1017064 0.91 SRD5A2 (0.83) SRD5A2RARBRARGNR1H4EPHX2

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
CN-113667308-B Composition capable of continuously extruding platinum vulcanized flame-retardant silicone rubber 力元材料科技(广东)有限公司 2022-10-18 CN disclosed
CN-113667308-A Composition capable of continuously extruding platinum vulcanized flame-retardant silicone rubber 力元材料科技(广东)有限公司 2021-11-19 CN disclosed