SCHEMBL24313002

SCHEMBL24313002

CNc1nc2cc(Br)c(F)cc2o1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.35
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
FBP1 P09467 2/20 0.32

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
SCHEMBL15337285 0.81 NPC1 (0.44) ELANENPC1RAB9AMAPTMEN1
SCHEMBL17708107 0.79 ELANE (0.34) ELANENPC1RAB9AMAPTMEN1
SCHEMBL18062406 0.78 ELANE (0.36) ELANENPC1RAB9AMAPTMEN1
SCHEMBL21604555 0.77 L3MBTL1 (0.41) ELANENPC1RAB9AMAPTMEN1
SCHEMBL30316275 0.77 L3MBTL1 (0.41) ELANENPC1RAB9AMAPTMEN1
SCHEMBL30408785 0.76 NPC1 (0.33) ELANENPC1RAB9AMAPTMEN1
SCHEMBL24251878 0.76 NPC1 (0.33) ELANENPC1RAB9AMAPTMEN1
SCHEMBL24313003 0.74 NPC1 (0.32) ELANENPC1RAB9AMAPTMEN1
SCHEMBL30437347 0.74 NPC1 (0.32) ELANENPC1RAB9AMAPTMEN1
SCHEMBL24313065 0.74 ESR1 (0.37) MAPTESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116096720-B Dihydropyrrolo [2,3-d ] pyridazin-7-one derivatives, preparation method and application thereof 上海和誉生物医药科技有限公司 2025-02-07 CN disclosed
CN-115867547-B 1H-pyrazole-4-amide derivative, preparation method and application thereof 上海和誉生物医药科技有限公司 2024-12-20 CN disclosed
CN-116096720-A Dihydropyrrolo [2,3-d ] pyridazin-7-one derivatives, preparation method and application thereof 上海和誉生物医药科技有限公司 2023-05-09 CN disclosed
CN-115867547-A 1H-pyrazole-4-amide derivative, and preparation method and application thereof 上海和誉生物医药科技有限公司 2023-03-28 CN disclosed
WO-2022042612-A1 DIHYDROPYRROLO[2,3-D]PYRIDAZIN-7-ONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海和誉生物医药科技有限公司 2022-03-03 WO disclosed