SCHEMBL10429239

SCHEMBL10429239

CCOC(=O)c1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1C(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAPT P10636 2/20 0.49
KDM4E B2RXH2 6/20 0.48
HPGD P15428 4/20 0.48
GAA P10253 4/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
HMGCR P04035 2/20 0.46
LMNA P02545 2/20 0.46
PRKCZ Q05513 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PTPN1 P18031 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GCGR P47871 1/20 0.46
RXFP1 Q9HBX9 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL9271574 0.89 PRKCZ (0.50) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL30189523 0.85 ALDH1A1 (0.57) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL8879993 0.85 HMGCR (0.49) ALDH1A1MAPTKDM4EHPGDHMGCR
SCHEMBL9562753 0.80 ADORA3 (0.52) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL2648212 0.78 GCGR (0.62) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL8319524 0.78 SMN1; SMN2 (0.61) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL397192 0.77 ADORA3 (0.60) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL8878404 0.77 HMGCR (0.48) MAPTKDM4EHPGDHMGCRGCGR
SCHEMBL30189329 0.77 ADORA3 (0.63) ALDH1A1L3MBTL1MAPTKDM4EHPGD
SCHEMBL28335019 0.77 ADORA3 (0.63) ALDH1A1L3MBTL1MAPTKDM4EHPGD

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
US-7323490-B2 Pyrrole compounds and uses thereof AMBIT BIOSCIENCES CORPORATION (US) 2008-01-29 US disclosed
US-4898868-A ANTICHOLESTEROL AGENTS; LACTONE OR FREE ACID FORM HOECHST AKTIENGESELLSCHAFT (DE) 1990-02-06 US disclosed