SCHEMBL7537396

SCHEMBL7537396

CCCCCCCC(=O)N[V](NC(=O)CCCCCCC)(C1=CC=CC1)C1=CC=CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.42
FAAH O00519 2/20 0.41
NAAA Q02083 3/20 0.40
EPHX2 P34913 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
TRPV1 Q8NER1 4/20 0.39
CNR1 P21554 2/20 0.39
CNR2 P34972 2/20 0.39
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38

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
SCHEMBL6242927 0.88 HSP90AA1 (0.42) HSP90AA1FAAHNAAAEPHX2MEN1
Hydrochloric Acid SCHEMBL7760605 0.70 EPHX2 (0.41) HSP90AA1FAAHNAAAEPHX2MEN1
Hydrochloric Acid SCHEMBL7759317 0.70 HSP90AA1 (0.41) HSP90AA1FAAHNAAAEPHX2MEN1
SCHEMBL25827828 0.70 TRPV1 (0.48) FAAHEPHX2MEN1KMT2ATRPV1
SCHEMBL12726010 0.68 DEGS1 (0.51) HSP90AA1FAAHMEN1KMT2AMAPK1
SCHEMBL6817875 0.65 KDM4E (0.46) FAAHMEN1KMT2ACNR1
SCHEMBL767119 0.65 HSD17B3 (0.42) MEN1KMT2A
SCHEMBL7108790 0.63 HSP90AA1 (0.70) HSP90AA1FAAHMEN1KMT2AMAPK1
SCHEMBL10481745 0.63 HSP90AA1 (0.70) HSP90AA1FAAHMEN1KMT2AMAPK1
SCHEMBL7103156 0.63 HSP90AA1 (0.70) HSP90AA1FAAHMEN1KMT2AMAPK1

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-0841375-B1 Impact-resistant polystyrene resin composition UBE INDUSTRIES (JP) 2002-05-22 EP disclosed
EP-0778291-B1 Catalyst and process for producing conjugated diene polymer UBE INDUSTRIES (JP) 2001-03-28 EP disclosed
US-6071845-A OBTAINED BY CONTACTING A COMPOUND OF A TRANSITION METAL OF THE GROUP V OF THE PERIODIC TABLE WITH AN IONIC COMPOUND COMPRISING A NON-COORDINATING ANION AND A CATION AND AN ALUMINOXANE UBE INDUSTRIES, LTD. (JP) 2000-06-06 US disclosed
US-5981667-A CONTAINING DISPERSED PARTICLES OF HIGH-CIS HIGH-VINYL POLYBUTADIENE COMPRISING FROM 65 TO 95% CIS-1,4-STRUCTURES AND FROM 30 TO 4% 1,2-STRUCTURES UBE INDUSTRIES, LTD. (JP) 1999-11-09 US disclosed
EP-0841375-A1 Impact-resistant polystyrene resin composition UBE INDUSTRIES, LTD. (JP) 1998-05-13 EP disclosed
EP-0778291-A1 Catalyst and process for producing conjugated diene polymer UBE INDUSTRIES, LTD. (JP) 1997-06-11 EP disclosed