SCHEMBL10364397

SCHEMBL10364397

CC1OC1Oc1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.45
SLC6A4 P31645 3/20 0.45
SLC6A3 Q01959 3/20 0.45
NFE2L2 Q16236 2/20 0.39
ACHE P22303 1/20 0.38
USP2 O75604 1/20 0.36
MAOB P27338 1/20 0.36
FFAR1 O14842 1/20 0.35
RELA Q04206 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
HTR1A P08908 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL7154266 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3NFE2L2ACHE
SCHEMBL10339033 0.86 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3ACHE
SCHEMBL31707544 0.79 ACHE (0.50) SLC6A2SLC6A4SLC6A3ACHE
SCHEMBL7918190 0.78 SLC6A4 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL11080783 0.77 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3MAOBNPC1
SCHEMBL7332087 0.76 NFE2L2 (0.36) NFE2L2ACHEMAOBNPC1RAB9A
SCHEMBL2282297 0.76 CA4 (0.40) SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL7752555 0.76 CA4 (0.40) SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL8551056 0.76 SOS1 (0.35) SLC6A4MAOBFFAR1
SCHEMBL11526012 0.75 KDM4E (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210849-B1 2-HYDROXY-3-PHENOXYPROPYL AMINES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-08-29 EP disclosed