SCHEMBL24746007

SCHEMBL24746007

Fc1cc(OCc2ccncc2)ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
AR P10275 1/20 0.43
MAOB P27338 3/20 0.43
TLR4 O00206 1/20 0.43
TLR2 O60603 1/20 0.43
MAOA P21397 2/20 0.42
NOX1 Q9Y5S8 1/20 0.41
CSF1R P07333 1/20 0.41
F2 P00734 2/20 0.40
KCNH2 Q12809 1/20 0.40
GRIN2B Q13224 1/20 0.40
EPHX2 P34913 1/20 0.40
PARP15 Q460N3 1/20 0.40
PARP10 Q53GL7 1/20 0.40
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL29468641 0.87 SMN1; SMN2 (0.46) SMN1; SMN2ARMAOBTLR4TLR2
SCHEMBL320455 0.83 MAOB (0.57) SMN1; SMN2MAOBMAOAPARP15PARP10
SCHEMBL29597315 0.83 MAOB (0.57) SMN1; SMN2MAOBMAOAPARP15PARP10
SCHEMBL19000545 0.81 MAOB (0.58) SMN1; SMN2MAOBMAOAPARP10MAPK1
SCHEMBL171645 0.81 MRGPRX4 (0.53) SMN1; SMN2ARMAOBTLR4TLR2
SCHEMBL12260777 0.81 SMN1; SMN2 (0.46) SMN1; SMN2ARMAOBTLR4TLR2
SCHEMBL17129526 0.78 AR (0.47) ARMAOBMAOA
SCHEMBL17128894 0.77 RXRA (0.50) ARMAOBMAOAKMT2A
SCHEMBL8135327 0.77 MAOB (0.54) SMN1; SMN2MAOBMAOA
SCHEMBL257670 0.77 MAOB (0.45) SMN1; SMN2ARMAOBMAOANOX1

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
CN-119431365-A Phenyl heterocyclic derivative-containing regulator and preparation method and application thereof 江苏豪森药业集团有限公司 2025-02-14 CN disclosed
CN-117120090-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-11-24 CN disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed