SCHEMBL28516108

SCHEMBL28516108

CNc1ccnc(Oc2cccc3c2ccn3-c2nc3ccc(F)cc3s2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 3/20 0.39
▸ NPC1 O15118 6/20 0.36
▸ RAB9A P51151 6/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ SLC2A1 P11166 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ MAOB P27338 1/20 0.34
▸ MAPT P10636 5/20 0.33
▸ TP53 P04637 2/20 0.33
▸ SLC11A2 P49281 1/20 0.33
▸ CSNK1D P48730 1/20 0.33
▸ LYN P07948 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ RHEB Q15382 1/20 0.32
▸ HTT P42858 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GRM1 Q13255 1/20 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
Hydrochloric Acid SCHEMBL28503674 0.99 APP (0.38) APPNPC1RAB9ASMN1; SMN2PDE10A
SCHEMBL18069327 0.84 NPC1 (0.35) NPC1RAB9ASMN1; SMN2PDE10ASLC2A1
SCHEMBL18049346 0.84 LOXL2 (0.42) NPC1RAB9ASMN1; SMN2PDE10AALDH1A1
SCHEMBL18049340 0.84 USP30 (0.36) NPC1RAB9ASMN1; SMN2PDE10ASLC2A1
Hydrochloric Acid SCHEMBL18049355 0.83 LOXL2 (0.41) NPC1RAB9ASMN1; SMN2PDE10AALDH1A1
SCHEMBL28505584 0.81 GRM1 (0.41) RHEBGRM1
Hydrochloric Acid SCHEMBL28507679 0.80 GRM1 (0.41) RHEBGRM1
SCHEMBL28505655 0.77 NPC1 (0.39) APPNPC1RAB9ASMN1; SMN2PDE10A
SCHEMBL28510258 0.72 TYRO3 (0.36) RHEB
SCHEMBL28507659 0.72 PIP4K2A (0.38) MAPTMEN1KMT2AGRM1

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-107624110-B Lysyl oxidase-like 2 inhibitors and uses thereof 法玛克亚公司 2021-01-26 — — CN disclosed
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