SCHEMBL7919475

SCHEMBL7919475

CC1C2=C(CCCC2)C2=C1C([Ti+](OC(=O)c1ccc(F)cc1)OC(=O)c1ccc(F)cc1)CCC2.C[O-]

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 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
Hydrochloric Acid SCHEMBL7924965 0.97 MEN1 (0.34) MEN1KMT2AKDM4ECYP1A2
SCHEMBL7924500 0.89 CHRNA7 (0.31) MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL7928369 0.86 CHRNA7 (0.32) MEN1KMT2ACYP1A2
SCHEMBL7931154 0.82 MEN1 (0.34) MEN1KMT2AKDM4E
SCHEMBL7928302 0.81 MEN1 (0.35) MEN1KMT2AKDM4E
SCHEMBL7931147 0.81 KDM4E (0.37) MEN1KMT2AKDM4ECYP1A2
SCHEMBL7930505 0.81
SCHEMBL7927220 0.78
SCHEMBL7925366 0.78 KMT2A (0.35) MEN1KMT2AKDM4ECYP1A2
SCHEMBL7924769 0.78

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-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed