SCHEMBL28274267

SCHEMBL28274267

C=CC(C=C)CCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 2/20 0.42
OPRM1 P35372 1/20 0.40
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
ADH4 P08319 1/20 0.40
ADH7 P40394 1/20 0.40
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
SPHK1 Q9NYA1 1/20 0.38
FFAR1 O14842 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL4023419 1.00 TSHR (0.46) TSHRLMNATHRBDNM1OPRM1
SCHEMBL4515246 1.00 TSHR (0.46) TSHRLMNATHRBDNM1OPRM1
SCHEMBL6336658 1.00 TSHR (0.46) TSHRLMNATHRBDNM1OPRM1
SCHEMBL6339666 1.00 TSHR (0.46) TSHRLMNATHRBDNM1OPRM1
SCHEMBL4530979 1.00 TSHR (0.46) TSHRLMNATHRBDNM1OPRM1
SCHEMBL27311941 0.97 TSHR (0.42) TSHRLMNATHRBDNM1OPRM1
Water SCHEMBL8815837 0.95 TSHR (0.40) TSHRLMNATHRBDNM1OPRM1
SCHEMBL23195 0.89
SCHEMBL1881575 0.86 ADH1B (0.44) TSHRLMNADNM1ADH1BADH1C
SCHEMBL4939881 0.86 ADH1B (0.44) TSHRLMNADNM1ADH1BADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109312077-A Curable silicon composition and its application and use 莫门蒂夫性能材料股份有限公司 2019-02-05 CN disclosed