SCHEMBL4379848

SCHEMBL4379848

FC(F)(F)c1cccc(OSCCc2c[nH]cn2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALOX15 P16050 1/20 0.37
MAOB P27338 1/20 0.36
AOC3 Q16853 1/20 0.36
HRH1 P35367 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
LTA4H P09960 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL8794633 0.84 ENPP2 (0.40) LMNAMAOB
SCHEMBL4385045 0.82 L3MBTL1 (0.47) KMT2AL3MBTL1LMNAPKMHSD17B10
SCHEMBL4385050 0.81 LMNA (0.48) KMT2AL3MBTL1LMNAPKMHSD17B10
SCHEMBL8934785 0.81 KDM4E (0.36) KMT2AL3MBTL1LMNAALDH1A1POLB
SCHEMBL224970 0.80 LMNA (0.50) KMT2AL3MBTL1LMNAPKMHSD17B10
SCHEMBL4386655 0.80 KDM4E (0.42) L3MBTL1ALDH1A1POLBKDM4EHRH1
SCHEMBL7991161 0.78 NPSR1 (0.43) KMT2AL3MBTL1ALDH1A1KDM4E
Oxalic Acid SCHEMBL7990786 0.76 KDM4E (0.52) KMT2AL3MBTL1LMNAALDH1A1KDM4E
SCHEMBL223971 0.76 TAAR1 (0.51) MAOBHRH1HRH4
SCHEMBL3840219 0.75 KDM4E (0.50) KMT2AKDM4E

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
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US claimed
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO claimed
EP-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP disclosed
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP disclosed
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO disclosed