SCHEMBL4733047

SCHEMBL4733047

C[SiH](C)OC(c1cc(C(F)(F)F)ccc1C(=O)C1CCCCC1)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTR1E P28566 1/20 0.35
S1PR3 Q99500 1/20 0.35
RXFP1 Q9HBX9 3/20 0.34
CFTR P13569 1/20 0.34
RAB9A P51151 2/20 0.34
SCN8A Q9UQD0 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
HPD P32754 1/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4609062 0.76 PDK2 (0.34) TSHRALDH1A1LMNARAB9A
SCHEMBL5326393 0.72 KDM4E (0.58) MEN1TSHRKMT2APTGDR2ALDH1A1
SCHEMBL1601510 0.70 CES2 (0.39) MEN1TSHRKMT2APTGDR2ALDH1A1
SCHEMBL1601508 0.68 CFTR (0.40) MEN1TSHRKMT2APTGDR2ALDH1A1
SCHEMBL26679561 0.68 HPD (0.67) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL1341192 0.68 KDM4E (0.47) MEN1TSHRKMT2AALDH1A1RXFP1
SCHEMBL1600945 0.67 CFTR (0.39) MEN1TSHRKMT2APTGDR2ALDH1A1
SCHEMBL9156406 0.65 GAA (0.49) MEN1TSHRKMT2AALDH1A1RXFP1
SCHEMBL6896656 0.65 MEN1 (0.51) MEN1TSHRKMT2AALDH1A1KDM4E
SCHEMBL26081057 0.65 HSD11B1 (0.58) MEN1TSHRKMT2AALDH1A1LMNA

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-1996564-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES Pfizer Products Incorporated (US) 2008-12-03 EP disclosed
WO-2007105050-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-09-20 WO disclosed