SCHEMBL2146177

SCHEMBL2146177

CC(C)(C)N1CCC(C(=O)N2CCCC2)C1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.52
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
TSHR P16473 2/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 2/20 0.41
NOTUM Q6P988 1/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL2146181 1.00 HPGD (0.52) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL14256463 0.91 HPGD (0.50) HPGDALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL14256462 0.90 HPGD (0.53) HPGDALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL25143794 0.89 HRH3 (0.43) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL25143725 0.89 HRH3 (0.43) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL20746951 0.89 HPGD (0.61) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL19001381 0.87 HPGD (0.64) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL10205143 0.85 HPGD (0.55) HPGDALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL21037188 0.85 CHRNB2 (0.58) HPGDALDH1A1SMN1; SMN2TSHRRECQL
SCHEMBL27022571 0.85 HPGD (0.41) HPGDALDH1A1SMN1; SMN2TSHRHTT

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
WO-2023191408-A1 COMBINATION THERAPY FOR PREVENTING OR TREATING OBESITY 주식회사 엘지화학 2023-10-05 WO disclosed
WO-2011088045-A1 AURORA KINASE COMPOUNDS AND METHODS OF THEIR USE AMBIT BIOSCIENCES CORPORATION (US) 2011-07-21 WO disclosed