SCHEMBL7930282

SCHEMBL7930282

C[Ti](C)(OC(=O)c1ccc(F)cc1)C1CCCC2=C1CC1=C2CCCC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
MAPT P10636 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.32
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
EPHX2 P34913 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CASP3 P42574 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
SENP7 Q9BQF6 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
SCHEMBL7931006 0.91 MEN1 (0.34) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7928322 0.89 MEN1 (0.33) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7924732 0.89 KMT2A (0.33) MEN1KMT2AKDM4ESLC6A4SLC6A3
SCHEMBL7927380 0.81 MEN1 (0.34) MEN1KMT2AKDM4EALDH1A1
SCHEMBL7927344 0.80 KMT2A (0.33) MEN1KMT2AKDM4ESLC6A4SLC6A3
SCHEMBL7925797 0.80
SCHEMBL7930285 0.78 MEN1 (0.40) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7927243 0.77 KMT2A (0.34) MEN1KMT2AKDM4ESLC6A4SLC6A3
SCHEMBL7924742 0.76 MEN1 (0.37) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7931134 0.76

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