SCHEMBL8445841

SCHEMBL8445841

NCCCCc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.67
HTR2A P28223 1/20 0.53
LTA4H P09960 2/20 0.53
PLA2G2A P14555 1/20 0.53
FFAR1 O14842 1/20 0.53
MAOB P27338 1/20 0.48

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
SCHEMBL22766219 0.98 MAOA (0.64) MAOAHTR2ALTA4HPLA2G2AFFAR1
SCHEMBL8638619 0.98 MAOA (0.64) MAOAHTR2ALTA4HPLA2G2AFFAR1
SCHEMBL2025420 0.94 MAOA (0.57) MAOAHTR2ALTA4HPLA2G2AFFAR1
SCHEMBL19322272 0.90 FFAR1 (0.62) LTA4HFFAR1MAOB
SCHEMBL19322285 0.88 FFAR1 (0.60) LTA4HFFAR1MAOB
SCHEMBL19322269 0.88 FFAR1 (0.60) LTA4HFFAR1MAOB
SCHEMBL19322273 0.88 FFAR1 (0.60) LTA4HFFAR1MAOB
SCHEMBL740325 0.86 HTR2A (0.62) MAOAHTR2ALTA4HPLA2G2AFFAR1
SCHEMBL12040543 0.86 FFAR1 (0.58) MAOALTA4HFFAR1MAOB
SCHEMBL28527968 0.86 HTR2A (0.62) MAOAHTR2ALTA4HPLA2G2AFFAR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618907-B1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS BRITISH TECH GROUP INT (GB) 1999-04-28 EP disclosed
US-5614614-A ANTIBIOTICS, CHEMICAL INTERMEDIATES ROUSSEL UCLAF (FR) 1997-03-25 US disclosed
US-5527780-A BACTERICIDES ROUSSEL UCLAF (FR) 1996-06-18 US disclosed
EP-0596802-B1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1996-03-20 EP disclosed
EP-0596802-A1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1994-05-11 EP disclosed