Sugi Predict

Sugi Predict / Compounds / SCHEMBL9545871

SCHEMBL9545871

SCHEMBL9545871

CCCCCCCCCCC=CCOCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 4/20 0.49
▸ FAAH O00519 2/20 0.49
▸ CNR1 P21554 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ PPARA Q07869 1/20 0.45
▸ SOAT2 O75908 1/20 0.44
▸ SOAT1 P35610 1/20 0.44
▸ CETP P11597 3/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL11895906 0.98 EPHX2 (0.47) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL11895904 0.98 EPHX2 (0.47) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL27731616 0.93 TSHR (0.47) EPHX2FAAHCNR1CNR2CETP
SCHEMBL14496883 0.87 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL23533338 0.87 EPHX2 (0.49) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL23533340 0.87 EPHX2 (0.49) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL9197255 0.87 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL23533392 0.87 EPHX2 (0.49) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL14496882 0.87 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA
SCHEMBL9197227 0.87 TDP1 (0.50) EPHX2FAAHCNR1CNR2PPARA

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
WO-1993025521-A1 ARYL ALIPHATIC ACIDS BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) 1993-12-23 — — WO disclosed