SCHEMBL7933391

SCHEMBL7933391

[Li]C1=C(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C=CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.36
POLQ O75417 8/20 0.35
CES2 O00748 2/20 0.34
SLC6A4 P31645 1/20 0.33
TACR1 P25103 1/20 0.32
IDO1 P14902 1/20 0.31

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
SCHEMBL7931646 0.77 TAAR1 (0.38) IDO1
SCHEMBL7931695 0.71 POLQ (0.39) DAOPOLQCES2SLC6A4TACR1
SCHEMBL1538523 0.69 DAO (0.49) DAOPOLQCES2SLC6A4TACR1
SCHEMBL5255556 0.67 POLQ (0.50) DAOPOLQCES2TACR1
SCHEMBL1993639 0.67 CES2 (0.52) DAOPOLQCES2IDO1
SCHEMBL13958202 0.66 DAO (0.46) DAOPOLQCES2SLC6A4TACR1
SCHEMBL3278364 0.66 CES2 (0.50) DAOPOLQCES2SLC6A4IDO1
SCHEMBL4416164 0.66 POLQ (0.51) DAOPOLQCES2IDO1
SCHEMBL1873922 0.66 DAO (0.46) DAOPOLQCES2SLC6A4TACR1
SCHEMBL964552 0.66 DAO (0.46) DAOPOLQCES2IDO1

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-0791607-B1 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM SPA (IT) 2001-05-02 EP disclosed
US-5936051-A FORMING POLYMERS OF HIGH MOLECULAR WEIGHT; CHEMICAL AND HEAT RESISTANCE; ALUMOXANE COCATALYSTS ENICHEM S.P.A. (IT) 1999-08-10 US disclosed
EP-0791607-A2 Substituted metallocene catalyst for the (co)polymerization of olefins ENICHEM S.p.A. (IT) 1997-08-27 EP disclosed