SCHEMBL25190902

SCHEMBL25190902

CCCCNc1nc(N)c2ccncc2n1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LATS1 O95835 9/20 0.54
▸ LATS2 Q9NRM7 5/20 0.54
▸ APP P05067 3/20 0.45
▸ TLR8 Q9NR97 2/20 0.42
▸ NPY1R P25929 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ KDM6B O15054 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ KCNH3 Q9ULD8 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
SCHEMBL25184747 0.96 LATS1 (0.55) LATS1LATS2APPNPY1RNPY5R
SCHEMBL26157393 0.78 LATS1 (0.68) LATS1LATS2APPTLR8
SCHEMBL26157394 0.74 LATS1 (0.69) LATS1LATS2APPTLR8
SCHEMBL24038281 0.72 APP (0.70) APPNPY5R
SCHEMBL26177090 0.70 LATS1 (1.00) LATS1LATS2
SCHEMBL250853 0.69 ACHE (0.42) LATS1LATS2KDM4C
SCHEMBL26157392 0.69 LATS1 (0.67) LATS1LATS2APP
SCHEMBL23260499 0.69 NPY5R (0.46) APPNPY1RNPY5R
SCHEMBL26157957 0.68 DCPS (0.55) —
SCHEMBL8891182 0.68 APP (0.63) APPNPY1RNPY5R

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-2023078241-A1 AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2023-05-11 — — WO disclosed
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