SCHEMBL6518166

SCHEMBL6518166

C1CCC(C(CC(C2CCCC2)C2CCCC2)C2CCCC2)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.55
SHBG P04278 1/20 0.41
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
MLNR O43193 1/20 0.41
ABCB11 O95342 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL9821330 0.97 EPHX1 (0.60) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL4654431 0.78 EPHX1 (0.42) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL29023351 0.74 EPHX1 (0.44) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL4653067 0.73 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL15915005 0.73 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1088601 0.73 EPHX1 (0.94) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1323184 0.73 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL4652981 0.73 SHBG (0.57) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL7429592 0.72 SHBG (0.48) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL9358590 0.71 EPHX1 (0.55) EPHX1SHBGTP53LMNACYP2D6

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-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed