SCHEMBL27464490

SCHEMBL27464490

CCCCn1c(=O)c(N(C(N)=O)c2c(C(C)C)cc(O)cc2C(C)C)c(-c2cccc(OC)c2)c2cccnc21

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.54
SOAT1 P35610 1/20 0.53
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37

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
SCHEMBL27480789 0.94 ACAT1 (0.61) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL27463675 0.93 ACAT1 (0.53) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL27483049 0.93 ACAT1 (0.54) ACAT1SOAT1ALDH1A1
SCHEMBL27482662 0.89 ACAT1 (0.53) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL27570663 0.88 ACAT1 (0.49) ACAT1SOAT1ALDH1A1
SCHEMBL27464491 0.88 ACAT1 (0.50) ACAT1SOAT1
SCHEMBL27464492 0.88 ACAT1 (0.52) ACAT1SOAT1
SCHEMBL27482312 0.88 ACAT1 (0.50) ACAT1SOAT1
SCHEMBL27483391 0.88 ACAT1 (0.50) ACAT1SOAT1
Piperidine SCHEMBL27464493 0.87 ACAT1 (0.51) ACAT1SOAT1

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-1152879-C Naphthyridine derivatives ס����ҩ��ʽ���� 2004-06-09 CN disclosed
CN-1323306-A Naphthyridine derivatives SUMITOMO PHARMA (JP) 2001-11-21 CN disclosed