SCHEMBL25199236

SCHEMBL25199236

O=C(Nc1nc2c(F)cc(F)cc2s1)[C@H]1CCCN(C(=O)O)C1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 9/20 0.68
▸ RAB9A P51151 8/20 0.68
▸ MAPT P10636 7/20 0.49
▸ POLB P06746 4/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ PKM P14618 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ CHKA P35790 1/20 0.49
▸ LMNA P02545 4/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ AGTR1 P30556 1/20 0.46
▸ OPRK1 P41145 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ GAA P10253 2/20 0.44

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
SCHEMBL25197014 1.00 NPC1 (0.68) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071501 0.91 NPC1 (0.70) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071507 0.91 NPC1 (0.67) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071510 0.91 NPC1 (0.67) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071512 0.88 NPC1 (0.61) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071505 0.88 NPC1 (0.63) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL31200477 0.87 NPC1 (0.60) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071451 0.87 NPC1 (0.67) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071592 0.86 RAB9A (0.69) NPC1RAB9AMAPTPOLBALDH1A1
SCHEMBL24071503 0.86 NPC1 (0.60) NPC1RAB9AMAPTPOLBALDH1A1

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
WO-2023096886-A1 ENHANCERS OF PARTICULATE GUANYLYL CYCLASE RECEPTOR A MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2023-06-01 — — WO disclosed
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