SCHEMBL38664361

SCHEMBL38664361

CC[C@@H]1CN(c2cncc(Cl)n2)[C@@H](CC)CN1C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.37
▸ GPR119 Q8TDV5 4/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ JAK3 P52333 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ HSP90AA1 P07900 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
SCHEMBL38664367 0.86 PARP1 (0.42) PARP1GPR119MEN1KMT2AALDH1A1
SCHEMBL38665461 0.86 PARP1 (0.42) PARP1GPR119MEN1KMT2AALDH1A1
SCHEMBL38665357 0.85 GPR119 (0.40) PARP1GPR119MEN1KMT2ACYP3A4
SCHEMBL38666465 0.85 GPR119 (0.40) PARP1GPR119MEN1KMT2ACYP3A4
SCHEMBL38666429 0.83 GPR119 (0.41) GPR119MEN1KMT2AMAP4K4
SCHEMBL5350081 0.79 PARP1 (0.51) PARP1GPR119GRM2
SCHEMBL38664019 0.78 HDAC1 (0.41) PARP1GPR119MEN1KMT2AALDH1A1
SCHEMBL38666115 0.78 HDAC1 (0.41) PARP1GPR119MEN1KMT2AALDH1A1
SCHEMBL38666731 0.78 HDAC1 (0.41) PARP1GPR119MEN1KMT2AALDH1A1
SCHEMBL38663338 0.77 GPR119 (0.38) GPR119MEN1KMT2AALDH1A1KDM4E

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-2026106389-A1 NMT INHIBITOR AND USE THEREOF 주식회사 이노보테라퓨틱스 2026-05-21 — — WO disclosed
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