SCHEMBL9752008

SCHEMBL9752008

COC(=O)C1Oc2ccccc2Cc2cc(C)ccc2O1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ACSL1 P33121 1/20 0.39
MEN1 O00255 2/20 0.38
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
GAA P10253 2/20 0.37
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL11809978 0.93 CA12 (0.40) KMT2ARAB9ASMN1; SMN2L3MBTL1MEN1
SCHEMBL10470237 0.92 RAB9A (0.39) KMT2ARAB9ASMN1; SMN2L3MBTL1MEN1
SCHEMBL9752005 0.89 MAOA (0.42) KMT2ARAB9AL3MBTL1ACSL1GABRA1
SCHEMBL10470754 0.81 HDAC4 (0.35) KMT2ARAB9ASMN1; SMN2ACSL1MEN1
SCHEMBL10470278 0.81 HTT (0.40) KMT2ASMN1; SMN2L3MBTL1MEN1GAA
SCHEMBL10470271 0.81 DRD2 (0.44) RAB9ASMN1; SMN2L3MBTL1GABRA1GABRB2
SCHEMBL9752013 0.81 KMT2A (0.38) KMT2AL3MBTL1MEN1GABRA1GABRB2
SCHEMBL12863007 0.78 GAA (0.45) KMT2ARAB9ASMN1; SMN2L3MBTL1GAA
SCHEMBL10472315 0.78 HDAC4 (0.35) KMT2AL3MBTL1ACSL1MEN1GABRA1
SCHEMBL10470798 0.78 CA12 (0.34) KMT2AL3MBTL1MEN1GABRA1GABRB2

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
EP-0439607-A4 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES 1991-12-04 EP disclosed
EP-0439607-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES ISK BIOSCIENCES CORPORATION (US) 1991-08-07 EP disclosed
WO-1991000009-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES FERMENTA ASC CORPORATION (US) 1991-01-10 WO disclosed
US-4976770-A POSTEMERGENCE, PREEMERGENCE HERBICIDES FERMENTA ASC CORPORATION (US) 1990-12-11 US disclosed