SCHEMBL6883932

SCHEMBL6883932

COC(=O)c1ccc(-c2cccc(OCc3ccc(COC(=O)c4ccccc4)c(COC(=O)c4ccccc4)c3)c2)c(C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.48
NR1H2 P55055 2/20 0.46
MRGPRX4 Q96LA9 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
NR4A2 P43354 2/20 0.41
NR4A1 P22736 1/20 0.41
NR4A3 Q92570 1/20 0.41
NR1H3 Q13133 1/20 0.41
SMPD1 P17405 1/20 0.40
DGAT2 Q96PD7 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL6889059 0.93 FFAR1 (0.48) FFAR1NR1H2MRGPRX4SMN1; SMN2MAPT
SCHEMBL6564131 0.93 MRGPRX4 (0.51) FFAR1NR1H2MRGPRX4NR4A2NR4A1
SCHEMBL6888101 0.88 MRGPRX4 (0.47) FFAR1NR1H2MRGPRX4SMN1; SMN2MAPT
SCHEMBL6882555 0.86 MRGPRX4 (0.55) FFAR1NR1H2MRGPRX4SMN1; SMN2MAPT
SCHEMBL6564818 0.81 MRGPRX4 (0.54) FFAR1MRGPRX4NR4A2NR4A1NR4A3
SCHEMBL6890556 0.81 NR1H2 (0.47) FFAR1NR1H2MRGPRX4SMN1; SMN2MEN1
SCHEMBL6883847 0.80 MRGPRX4 (0.47) FFAR1NR1H2MRGPRX4SMN1; SMN2MAPT
SCHEMBL6887724 0.79 MRGPRX4 (0.53) MRGPRX4SMN1; SMN2MAPTALDH1A1RAB9A
SCHEMBL6882624 0.79 SMN1; SMN2 (0.45) FFAR1MRGPRX4SMN1; SMN2MAPTMEN1
SCHEMBL6883961 0.78 MRGPRX4 (0.55) MRGPRX4SMN1; SMN2MAPTALDH1A1RAB9A

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