SCHEMBL29463252

SCHEMBL29463252

CCOCn1c(C(=O)OCC)cc2cc(N)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 2/20 0.47
NOD1 Q9Y239 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
F10 P00742 3/20 0.45
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAOA P21397 1/20 0.43
ADORA3 P0DMS8 2/20 0.42
CCR2 P41597 1/20 0.41
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ELANE P08246 1/20 0.39
MAPT P10636 2/20 0.39

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
SCHEMBL23045688 1.00 NOD2 (0.47) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL29463233 0.90 NOD2 (0.47) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL23045587 0.90 NOD2 (0.47) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL4194183 0.88 NOD2 (0.50) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL21464406 0.87 MEN1 (0.42) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL30615347 0.87 MEN1 (0.42) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL31383524 0.86 KDM4E (0.52) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL23045603 0.86 KDM4E (0.52) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL18733435 0.85 TSHR (0.57) NOD2NOD1MEN1KMT2AKDM4E
SCHEMBL23045589 0.84 KDM4E (0.50) NOD2NOD1MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114302874-B Indole carboxamide derivatives and pharmaceutical compositions containing the same 国际药品株式会社 2025-02-25 CN disclosed
CN-114302874-A Indole carboxamide derivatives and pharmaceutical compositions comprising same 国际药品株式会社 2022-04-08 CN disclosed