Sugi Predict

Sugi Predict / Compounds / SCHEMBL31058596

SCHEMBL31058596

SCHEMBL31058596

O=C(OCCCCCl)C(Cl)(Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NAAA Q02083 1/20 0.30

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
SCHEMBL31058595 0.93 CA1 (0.33) ALDH1A1
SCHEMBL9420651 0.83 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL9937565 0.80 POLB (0.40) EPHX1ALDH1A1CYP3A4TSHRNAAA
SCHEMBL9489882 0.80 EPHX1 (0.53) EPHX1ALDH1A1CYP3A4TSHRNAAA
SCHEMBL1457249 0.80 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL20032696 0.78 POLB (0.39) EPHX1ALDH1A1CYP3A4TSHRNAAA
SCHEMBL6642350 0.78 TSHR (0.39) EPHX1ALDH1A1CYP3A4TSHRNAAA
SCHEMBL6638744 0.78 TSHR (0.39) EPHX1ALDH1A1CYP3A4TSHRNAAA
SCHEMBL1456856 0.78 EPHX1 (0.57) EPHX1ALDH1A1TSHRNAAA
SCHEMBL5583745 0.78 EPHX1 (0.57) EPHX1ALDH1A1TSHRNAAA

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
CN-116023544-B Catalyst component for olefin polymerization, preparation method thereof, catalyst and olefin polymerization method 中国石油化工股份有限公司 2024-12-06 — — CN disclosed
CN-116023542-B Catalyst component, catalyst and preparation method and application thereof 中国石油化工股份有限公司 2024-09-17 — — CN disclosed