Sugi Predict

Sugi Predict / Compounds / SCHEMBL7788732

SCHEMBL7788732

SCHEMBL7788732

C=C(C)C(Cl)CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)CCOCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 2/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ ICMT O60725 2/20 0.35
▸ TRPV1 Q8NER1 1/20 0.33
▸ MPO P05164 1/20 0.32
▸ TPO P07202 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32

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
SCHEMBL7788734 1.00 LSS (0.37) LSSALOX15ICMTTRPV1MPO
SCHEMBL7785617 0.88 LSS (0.38) LSSALOX15ICMTTRPV1
SCHEMBL7785615 0.88 LSS (0.38) LSSALOX15ICMTTRPV1
SCHEMBL7781148 0.85 LSS (0.40) LSSALOX15ICMTTRPV1
SCHEMBL7781152 0.85 LSS (0.40) LSSALOX15ICMTTRPV1
SCHEMBL7781153 0.83 HTT (0.38) MPOTPOCYP3A4
SCHEMBL7790127 0.81 HTT (0.36) ALOX15MPOTPOCYP3A4
SCHEMBL7790130 0.81 HTT (0.36) ALOX15MPOTPOCYP3A4
SCHEMBL7930882 0.78 ALOX15 (0.49) ALOX15
SCHEMBL29217260 0.72 TSHR (0.42) MPOTPOCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873982-B1 Process for preparing polyprenols KURARAY CO (JP) 2001-10-31 — — EP disclosed
US-5981811-A DEHALOGENATING A TERMINAL ALLYL HALIDE, THEREBY FORMING A CARBON-CARBON DOUBLE BOND AT A SELECTED POSITION KURARAY CO., LTD. (JP) 1999-11-09 — — US disclosed
EP-0873982-A1 Process for preparing polyprenols KURARAY CO., LTD. (JP) 1998-10-28 — — EP disclosed