SCHEMBL7554948

SCHEMBL7554948

[CH2]CCc1ccc(CCCCC(=O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.66
▸ RXFP1 Q9HBX9 1/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ HDAC3 O15379 1/20 0.59
▸ MAPK1 P28482 1/20 0.59
▸ ADRA1A P35348 1/20 0.59
▸ HDAC4 P56524 1/20 0.59
▸ SLC6A3 Q01959 1/20 0.59
▸ HDAC1 Q13547 1/20 0.59
▸ HDAC7 Q8WUI4 1/20 0.59
▸ HDAC2 Q92769 1/20 0.59
▸ HDAC10 Q969S8 1/20 0.59
▸ HDAC11 Q96DB2 1/20 0.59
▸ HDAC8 Q9BY41 1/20 0.59
▸ HDAC6 Q9UBN7 1/20 0.59
▸ HDAC9 Q9UKV0 1/20 0.59
▸ HDAC5 Q9UQL6 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.55
▸ FFAR1 O14842 3/20 0.51
▸ TBXAS1 P24557 7/20 0.50

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
SCHEMBL7065645 0.89 MAPT (0.79) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL9671779 0.87 MAPT (0.83) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL3814880 0.87 MAPT (0.83) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL7827144 0.85 MAPT (0.80) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL296500 0.84 MAPT (0.66) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL7825139 0.83 MAPT (0.70) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL6208836 0.83 SMN1; SMN2 (0.82) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL418561 0.82 MAPT (0.68) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
SCHEMBL27978172 0.82 MAPT (0.68) MAPTRXFP1SMN1; SMN2HDAC3MAPK1
5-Phenylvaleric Acid SCHEMBL503601 0.81 MAPT (0.96) MAPTRXFP1SMN1; SMN2HDAC3MAPK1

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
EP-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 — — EP disclosed
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