SCHEMBL31575969

SCHEMBL31575969

FC(F)Oc1cnc(Cl)cc1Br

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ PDE4D Q08499 1/20 0.32
▸ RXRA P19793 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ LRRK2 Q5S007 1/20 0.31
▸ MBOAT4 Q96T53 1/20 0.30
▸ ENPP1 P22413 1/20 0.30

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
SCHEMBL16783059 0.85 RXRA (0.34) L3MBTL1PDE4DRXRANPC1MAPT
SCHEMBL28061249 0.81 MAPT (0.38) L3MBTL1PDE4DRXRANPC1MAPT
SCHEMBL14353980 0.81 RXRA (0.33) RXRA
SCHEMBL28061248 0.78 TDP1 (0.32) PDE4DRXRANPC1MAPTNFKB1
SCHEMBL20642463 0.78 ALDH1A1 (0.36) PDE4DRXRAMAPTLRRK2
SCHEMBL17979413 0.78 GAA (0.32) PDE4DNPC1MAPTNFKB1RAB9A
SCHEMBL29695090 0.78 GAA (0.32) PDE4DNPC1MAPTNFKB1RAB9A
SCHEMBL29739284 0.76 GRIN2B (0.38) PDE4DRXRANPC1MAPTNFKB1
SCHEMBL30681788 0.75 AXL (0.41) L3MBTL1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL30681784 0.75 AXL (0.41) L3MBTL1NPC1MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120020133-A Nitrogen-containing heterocyclic derivative and medical application thereof 杭州百新生物医药科技有限公司 2025-05-20 — — CN disclosed
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