SCHEMBL22673718

SCHEMBL22673718

CCOC(=O)c1ccc(C(=O)C(OC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C(=O)OCC)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.48
▸ LMNA P02545 1/20 0.45
▸ ALDH1A1 P00352 6/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ POLB P06746 3/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 1/20 0.42

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
SCHEMBL28487170 0.91 HPGD (0.53) HPGDALDH1A1SMN1; SMN2POLBNPC1
SCHEMBL16597715 0.89 TSHR (0.49) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL22673922 0.89 KMT2A (0.47) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL22673801 0.85 MEN1 (0.53) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL16597967 0.84 PARP10 (0.43) HPGDALDH1A1MEN1KMT2AMAPT
SCHEMBL28487173 0.83 HPGD (0.47) HPGDALDH1A1SMN1; SMN2POLBNPC1
SCHEMBL22673848 0.83 MEN1 (0.49) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL22673925 0.83 ATM (0.40) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL22674058 0.82 MEN1 (0.50) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL22674061 0.82 MEN1 (0.50) HPGDLMNAALDH1A1MEN1KMT2A

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
EP-3966204-A1 SUBSTITUTED 1-AMINO-1H-IMIDAZOLE-5-CARBOXAMIDE AS BRUTON'S TYROSINE KINASE INHIBITORS Nenan Normal University (CN) 2022-03-16 — — EP disclosed
WO-2020228637-A1 SUBSTITUTED 1-AMINO-1H-IMIDAZOLE-5-CARBOXAMIDE AS BRUTON'S TYROSINE KINASE INHIBITORS HENAN NORMAL UNIVERSITY (CN) 2020-11-19 — — WO disclosed
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