SCHEMBL7861951

SCHEMBL7861951

COC(=O)CCCCC(=O)OC12CCCCC1O2

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.41
TSHR P16473 3/20 0.39
PRKCA P17252 2/20 0.36
LMNA P02545 2/20 0.35
KMT2A Q03164 2/20 0.35
NAAA Q02083 2/20 0.35
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL8461185 0.93 NAAA (0.36) EPHX2LMNANAAAPOLB
SCHEMBL5080475 0.87 LMNA (0.33) EPHX2TSHRLMNANAAAALDH1A1
SCHEMBL28979883 0.81 LMNA (0.41) LMNAALDH1A1
SCHEMBL5608046 0.80 CYP2C19 (0.33) TSHRLMNA
SCHEMBL7600518 0.75 EP300 (0.31)
SCHEMBL10952862 0.72 EPHX2 (0.42) EPHX2TSHRLMNAKMT2ANAAA
SCHEMBL7600537 0.71 SMN1; SMN2 (0.33) KMT2AMEN1
SCHEMBL28979881 0.70
SCHEMBL5675346 0.69
SCHEMBL9647530 0.68

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
US-6312621-B1 BIS/3,4-EPOXYCYCLOHEXYL/METHYL ADIPATE, 3,4-EPOXYCYCLOHEXYL METHYL 3,4-EPOXYCYCLOHEXANE/CARBOXYLATE, BIS/4-CYANATOPHENYL/ ETHANE, EPOXIDIZED POLYBUTADIENE, TITANIUM-AND/OR ZIRCONIUM-BASED LEWIS ACID CATALYST, DIBENZYLIDENE SORBITOL. JOHNSON MATTHEY ELECTRONICS, INC. 2001-11-06 US claimed