SCHEMBL8758552

SCHEMBL8758552

Clc1cccc2ccc[nH+]c12.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2A6 P11509 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
Quinoline SCHEMBL1193953 0.73 — —
Benzene SCHEMBL28592113 0.62 — —
SCHEMBL5909814 0.62 ALDH1A1 (0.39) CYP1A2CYP2A6
SCHEMBL29594837 0.62 — —
SCHEMBL2589832 0.61 ALDH1A1 (0.33) CYP1A2CYP2A6
Pyridine SCHEMBL1135155 0.60 — —
SCHEMBL3917579 0.60 — —
SCHEMBL22478 0.60 — —
SCHEMBL8591536 0.60 — —
SCHEMBL5416211 0.59 CYP2A6 (0.34) CYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505890-B1 Process for producing a styrenic polymer IDEMITSU KOSAN CO (JP) 1997-05-28 — — EP claimed
US-5294685-A Process for producing a styrenic polymer having a high degree of syndiotacticity IDEMITSU KOSAN CO., LTD. (JP) 1994-03-15 — — US claimed
EP-0505890-A2 Process for producing a styrenic polymer and a catalyst for use therein IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 — — EP claimed
EP-0505890-B1 Process for producing a styrenic polymer IDEMITSU KOSAN CO (JP) 1997-05-28 — — EP disclosed
US-5294685-A Process for producing a styrenic polymer having a high degree of syndiotacticity IDEMITSU KOSAN CO., LTD. (JP) 1994-03-15 — — US disclosed
EP-0505890-A2 Process for producing a styrenic polymer and a catalyst for use therein IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 — — EP disclosed
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