SCHEMBL9070348

SCHEMBL9070348

Cc1cccc(Nc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 1/20 0.68
▸ NPSR1 Q6W5P4 1/20 0.60
▸ RAB9A P51151 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ IDH2 P48735 3/20 0.58
▸ KIF11 P52732 3/20 0.58
▸ THRB P10828 1/20 0.56
▸ APP P05067 1/20 0.55
▸ MAPT P10636 4/20 0.54
▸ GAA P10253 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ KCNK3 O14649 1/20 0.54
▸ KCNK9 Q9NPC2 1/20 0.54
▸ MAPK1 P28482 2/20 0.53
▸ FFAR1 O14842 1/20 0.53
▸ CDK1 P06493 1/20 0.53
▸ CCNB1 P14635 1/20 0.53

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
SCHEMBL4544808 0.89 IDH2 (0.77) RAPGEF4IDH2APPMAPTMAPK1
SCHEMBL394991 0.88 KIF11 (0.70) RAPGEF4NPSR1RAB9AHTTMEN1
SCHEMBL8971887 0.87 APP (0.69) RAPGEF4NPSR1RAB9AHTTIDH2
SCHEMBL1921482 0.84 KIF11 (0.70) RAPGEF4NPSR1RAB9AIDH2KIF11
SCHEMBL11114688 0.83 MAPT (0.62) RAPGEF4RAB9AHTTMEN1KMT2A
SCHEMBL7347670 0.82 IDH2 (0.77) RAPGEF4RAB9AHTTMEN1KMT2A
SCHEMBL30575363 0.82 IDH2 (0.77) RAPGEF4RAB9AHTTMEN1KMT2A
SCHEMBL148048 0.82 NFE2L2 (0.55) RAPGEF4RAB9AHTTMEN1KMT2A
SCHEMBL6728267 0.82 MEN1 (0.63) RAPGEF4NPSR1RAB9AHTTMEN1
SCHEMBL22065211 0.82 MAPT (0.72) NPSR1RAB9AHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246028-A1 QUINOLINE COMPOUNDS FOR INCREASING INSULINE RELEASE Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2017-11-22 — — EP disclosed
EP-0475676-B1 Electrophotographic member HITACHI CHEMICAL CO LTD (JP) 1996-04-03 — — EP disclosed
Send feedback