SCHEMBL31039366

SCHEMBL31039366

Clc1ccc(Br)c(-c2cc[nH]n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.38
F7 P08709 1/20 0.37
F3 P13726 1/20 0.37
DYRK1A Q13627 1/20 0.37
S100A4 P26447 2/20 0.35
HPGD P15428 5/20 0.34
MAPT P10636 4/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
AMY1A P0DUB6 3/20 0.33
PPOX P50336 1/20 0.32
NPSR1 Q6W5P4 3/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MCL1 Q07820 1/20 0.31
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL25299734 0.86 F7 (0.37) IDO1F7F3DYRK1AS100A4
SCHEMBL11624239 0.81 IDO1 (0.56) IDO1F7F3DYRK1AHPGD
SCHEMBL31645039 0.79 RAB9A (0.34) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL6031031 0.79 IDO1 (0.58) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL14400038 0.79 IDO1 (0.58) IDO1F7F3DYRK1AHPGD
SCHEMBL15079440 0.79 IDO1 (0.58) IDO1F7F3DYRK1A
SCHEMBL8755367 0.78 AMY1A (0.35) IDO1AMY1A
SCHEMBL3846339 0.78 ALPL (0.49) IDO1F7F3DYRK1AMAPT
SCHEMBL3846744 0.75 KMO (0.44) IDO1F7F3DYRK1AAMY1A
SCHEMBL25303474 0.75 HAO1 (0.31) IDO1SMN1; SMN2KDM4EALDH1A1

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-4655296-A1 CBL-B INHIBITORS Aurigene Oncology Limited (IN) 2025-12-03 EP disclosed
WO-2024156938-A1 CBL-B INHIBITORS ORION CORPORATION (FI) 2024-08-02 WO disclosed