SCHEMBL38663142

SCHEMBL38663142

C[C@H]1CN(C)CCN1c1cncc(Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
HTR1A P08908 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GSK3B P49841 2/20 0.39
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
CCNT1 O60563 1/20 0.34

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
SCHEMBL12969650 0.78 NR1H2 (0.42) ALDH1A1CYP1A2HTR2AHTR2CCYP2C19
SCHEMBL1326312 0.77 ALDH1A1 (0.44) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL3266317 0.75 HTR2C (0.56) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL3272320 0.75 HTR2C (0.56) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL3056725 0.74 KDM4E (0.64) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL38665383 0.73 GPR119 (0.48)
SCHEMBL38666760 0.73 GPR119 (0.48)
SCHEMBL22578912 0.73 ALK (0.39) CYP1A2CYP2C19KMT2AGSK3BATR
SCHEMBL22578911 0.73 ALK (0.39) CYP1A2CYP2C19KMT2AGSK3BATR
Hydrochloric Acid SCHEMBL11557145 0.72 KDM4E (0.62) KDM4EMEN1ALDH1A1CYP1A2CYP3A4

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