SCHEMBL9348186

SCHEMBL9348186

CCC1Oc2ccccc2C(O)C1CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.39
LTB4R Q15722 2/20 0.38
LTB4R2 Q9NPC1 2/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
USP2 O75604 1/20 0.36
ABCB1 P08183 2/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GRM8 O00222 1/20 0.34
GRM7 Q14831 1/20 0.34
GRM4 Q14833 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
PKM P14618 1/20 0.33
MAPT P10636 1/20 0.33
EGFR P00533 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
Propionic Acid SCHEMBL7472691 0.84 KMT2A (0.39) CYP2C9LTB4RLTB4R2KMT2AMEN1
SCHEMBL8787996 0.81 KMT2A (0.39) KMT2AMEN1USP2ABCB1TSHR
SCHEMBL5542843 0.80 MAOA (0.41) CYP2C9LTB4RLTB4R2KMT2AMEN1
SCHEMBL9345601 0.75 CYP2C9 (0.38) CYP2C9LTB4RLTB4R2KMT2AMEN1
SCHEMBL8427998 0.74 KMT2A (0.41) KMT2AMEN1USP2ABCB1TSHR
SCHEMBL7422948 0.74 KMT2A (0.41) KMT2AMEN1USP2ABCB1TSHR
SCHEMBL13062858 0.71 ABCB1 (0.57) KMT2AMEN1USP2ABCB1TSHR
SCHEMBL5542835 0.70 ABCB1 (0.41) KMT2AMEN1USP2ABCB1TSHR
SCHEMBL9819039 0.69 HTT (0.40) KMT2AMEN1USP2MAPT
SCHEMBL9819041 0.69 HTT (0.40) KMT2AMEN1USP2MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5288752-A Brain disorders SUNTORY LIMITED (JP) 1994-02-22 US disclosed
EP-0322248-B1 COMPOUNDS EFFECTIVE AGAINST CEREBRAL INSUFFICIENCY SUNTORY LIMITED (JP) 1993-08-04 EP disclosed
US-5179092-A Cognition activators SUNTORY LIMITED (JP) 1993-01-12 US disclosed
US-5057514-A Compounds effective as cerebral schemia treating agents SUNTORY LIMITED (JP) 1991-10-15 US disclosed