SCHEMBL8328266

SCHEMBL8328266

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1c(-c2cccc(OCCCn3cncn3)c2)c2cccnc2n(Cc2ccccc2)c1=O

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.59
SOAT1 P35610 1/20 0.57
TSHR P16473 1/20 0.40
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 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
SCHEMBL8329157 0.97 ACAT1 (0.58) ACAT1SOAT1MAPTKDM4ELMNA
SCHEMBL8322290 0.94 ACAT1 (0.61) ACAT1SOAT1TSHRMAPTKDM4E
SCHEMBL8328562 0.91 ACAT1 (0.66) ACAT1SOAT1TSHR
SCHEMBL8321514 0.91 ACAT1 (0.61) ACAT1SOAT1TSHR
SCHEMBL8327943 0.91 ACAT1 (0.69) ACAT1SOAT1TSHR
SCHEMBL8327651 0.91 ACAT1 (0.64) ACAT1SOAT1MAPT
SCHEMBL6633521 0.91 ACAT1 (0.71) ACAT1SOAT1TSHR
SCHEMBL8327438 0.91 ACAT1 (0.62) ACAT1SOAT1MAPT
SCHEMBL8327599 0.90 ACAT1 (0.59) ACAT1SOAT1TSHR
SCHEMBL8329688 0.89 ACAT1 (0.61) ACAT1SOAT1TSHR

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
EP-0947515-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-10-06 EP disclosed