SCHEMBL8024822

SCHEMBL8024822

CCc1cccc2c1C=CC2[Ti](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.30
GABRA1 P14867 2/20 0.30
GABRB2 P47870 2/20 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
SCHEMBL5888557 0.73 SIGMAR1 (0.39) TP53
Hydrochloric Acid SCHEMBL8024789 0.67 GABRA1 (0.36) GABRA1GABRB2
SCHEMBL10841213 0.61 HTR2A (0.41) TP53GABRA1GABRB2
SCHEMBL7754820 0.61 SIGMAR1 (0.39) TP53
SCHEMBL6548117 0.60 HTR2A (0.56) TP53
Ethylbenzene SCHEMBL11185461 0.60 TP53 (0.78) TP53GABRA1GABRB2
Ethylbenzene SCHEMBL27633722 0.60 TP53 (0.78) TP53GABRA1GABRB2
Ethylbenzene SCHEMBL3227891 0.60 TP53 (0.78) TP53GABRA1GABRB2
SCHEMBL6251452 0.60
SCHEMBL4215410 0.60 HTR2A (0.38) TP53

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-0796875-B1 Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM SPA (IT) 2000-03-29 EP disclosed
US-5721327-A Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM S.P.A. (IT) 1998-02-24 US disclosed
EP-0796875-A2 Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM S.p.A. (IT) 1997-09-24 EP disclosed