SCHEMBL29934976

SCHEMBL29934976

COc1cc(F)c(Br)cc1N

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.69
POLB P06746 1/20 0.69
GAA P10253 2/20 0.45
PKM P14618 1/20 0.44
MAPT P10636 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 7/20 0.42
CYP3A4 P08684 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
S100B P04271 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
APP P05067 1/20 0.39
NPC1 O15118 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
SCHEMBL15561596 1.00 L3MBTL1 (0.69) L3MBTL1POLBGAAPKMMAPT
SCHEMBL31069479 0.92 L3MBTL1 (0.69) L3MBTL1POLBGAAPKMMAPT
SCHEMBL1239490 0.92 L3MBTL1 (0.69) L3MBTL1POLBGAAPKMMAPT
SCHEMBL29126384 0.90 L3MBTL1 (0.67) L3MBTL1POLBGAAPKMMAPT
SCHEMBL16650823 0.83 POLB (0.57) L3MBTL1POLBMAPTNPSR1HTR2A
SCHEMBL29934779 0.83 POLB (0.57) L3MBTL1POLBMAPTNPSR1HTR2A
SCHEMBL30313255 0.82 L3MBTL1 (0.54) L3MBTL1POLBGAAPKMMAPT
SCHEMBL31085113 0.82 PRKDC (0.48) L3MBTL1POLBMAPTNPSR1CYP3A4
SCHEMBL5946312 0.82 L3MBTL1 (1.00) L3MBTL1POLBGAAPKMMAPT
SCHEMBL569225 0.82 L3MBTL1 (0.54) L3MBTL1POLBGAAPKMMAPT

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-4402133-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS Enko Chem, Inc. (US) 2024-07-24 EP disclosed
WO-2023044364-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS ENKO CHEM, INC. (US) 2023-03-23 WO disclosed
EP-4058435-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2022-09-21 EP disclosed