SCHEMBL6890556

SCHEMBL6890556

COC(=O)c1cc(C)c(-c2cccc(OCc3ccc(COC(=O)c4ccccc4)c(COC(=O)c4ccccc4)c3)c2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.47
MRGPRX4 Q96LA9 2/20 0.46
FFAR1 O14842 12/20 0.46
FFAR4 Q5NUL3 1/20 0.44
SMPD1 P17405 1/20 0.43
NR4A2 P43354 1/20 0.43
MAOB P27338 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6563998 0.92 MRGPRX4 (0.53) MRGPRX4FFAR1FFAR4NR4A2MAOB
SCHEMBL6888101 0.89 MRGPRX4 (0.47) NR1H2MRGPRX4FFAR1FFAR4SMPD1
SCHEMBL6882555 0.88 MRGPRX4 (0.55) NR1H2MRGPRX4FFAR1SMPD1NR4A2
SCHEMBL6885435 0.86 MRGPRX4 (0.41) MRGPRX4FFAR1MAOBMEN1KMT2A
SCHEMBL6883847 0.86 MRGPRX4 (0.47) NR1H2MRGPRX4FFAR1SMPD1NR4A2
SCHEMBL6887724 0.83 MRGPRX4 (0.53) MRGPRX4SMPD1NR4A2MAOBSMN1; SMN2
SCHEMBL6564818 0.83 MRGPRX4 (0.54) MRGPRX4FFAR1FFAR4NR4A2
SCHEMBL6883961 0.82 MRGPRX4 (0.55) MRGPRX4SMPD1NR4A2MAOBSMN1; SMN2
SCHEMBL6889652 0.82 RAB9A (0.52) MRGPRX4KMT2ASMN1; SMN2
SCHEMBL6562981 0.82 MRGPRX4 (0.52) MRGPRX4SMPD1NR4A2MAOB

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
US-6831106-B1 Selective activity on cell proliferation and differentiation without displaying any hypercalcaemiant nature GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-12-14 US disclosed