SCHEMBL5147488

SCHEMBL5147488

COC(C)(OC)c1sccc1-c1ccccc1.O=CCc1cc(-c2ccccc2)cs1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
PRKCZ Q05513 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PTGS2 P35354 1/20 0.31

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
SCHEMBL2983283 0.79 PTGS2 (0.41) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL5147277 0.78 CYP11B1 (0.45) ALDH1A1CYP11B1CYP11B2
SCHEMBL23618659 0.64 BCAT2 (0.43) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL10366618 0.64 CYP11B1 (0.43) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL2600064 0.63 CYP11B1 (0.45) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL5147356 0.63 BCAT2 (0.43) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL988896 0.61 CYP11B1 (0.49) ALDH1A1CYP11B1CYP11B2
SCHEMBL12531530 0.61 CYP11B1 (0.49) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL5490841 0.60 HTT (0.31) ALDH1A1CYP11B1CYP11B2
SCHEMBL20132762 0.60 CYP11B1 (0.42) MEN1KMT2AALDH1A1LMNAHPGD

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
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO disclosed