SCHEMBL9354456

SCHEMBL9354456

COc1c(N)ccc2c1C(=O)c1cc(C(F)(F)F)c(N)cc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 9/20 0.38
▸ PARP1 P09874 1/20 0.36
▸ RAB9A P51151 3/20 0.35
▸ POLB P06746 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MAPT P10636 3/20 0.35
▸ THRB P10828 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ FGB P02675 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ NCOA2 Q15596 1/20 0.35
▸ NCOA1 Q15788 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ GLA P06280 2/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL3900138 0.71 MAPT (0.41) RAB9APOLBALDH1A1MAPTTHRB
SCHEMBL3884186 0.66 CES1 (0.37) PARP1POLBMAPTTHRBMEN1
SCHEMBL7970824 0.65 RAB9A (0.65) RAB9APOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL30449781 0.64 KIF11 (0.41) FFAR4RAB9APOLBMAPTTHRB
SCHEMBL1771689 0.64 AR (0.51) —
SCHEMBL77088 0.62 FFAR4 (0.56) FFAR4RAB9AALDH1A1MAPTTHRB
SCHEMBL2957938 0.62 CTSS (0.40) PARP1POLBALDH1A1MAPTMEN1
SCHEMBL11246302 0.62 ALDH1A1 (0.66) RAB9APOLBALDH1A1MAPTTHRB
SCHEMBL29961263 0.62 FFAR4 (0.56) FFAR4RAB9AALDH1A1MAPTTHRB
SCHEMBL15916070 0.61 FFAR4 (0.35) FFAR4RAB9APOLBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0322586-B1 Photo-receptor for electrophotography KONISHIROKU PHOTO IND (JP) 1994-11-02 — — EP disclosed
US-4939058-A Durability KONICA CORPORATION (JP) 1990-07-03 — — US disclosed
EP-0322586-A2 Photo-receptor for electrophotography KONICA CORPORATION (JP) 1989-07-05 — — EP disclosed
Send feedback