SCHEMBL7908294

SCHEMBL7908294

CCCC[C@H]1CC[C@H](C(=O)Oc2ccc(C)nc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MAPT P10636 3/20 0.52
GAA P10253 1/20 0.42
HTT P42858 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
F2 P00734 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
IDH1 O75874 1/20 0.38

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
SCHEMBL7908296 1.00 KMT2A (0.52) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27324727 0.99 KMT2A (0.51) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL7910394 0.96 KMT2A (0.51) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL30172 0.96 KMT2A (0.51) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27328016 0.95 KMT2A (0.50) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27508948 0.95 KMT2A (0.50) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27306208 0.95 KMT2A (0.50) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27299978 0.95 KMT2A (0.50) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27301975 0.95 KMT2A (0.50) KMT2AMAPTGAAHTTSMN1; SMN2
SCHEMBL27311093 0.94 KMT2A (0.49) KMT2AMAPTGAAHTTSMN1; SMN2

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-6210760-B1 SHORT SWITCHING TIMES AND GRADIENTS AND ANGULAR DEPENDENCIES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2001-04-03 US disclosed
US-5876626-A HIGH SPEED SWITCHING MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-03-02 US disclosed
US-5387369-A With specified mixture of components; short switching times MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-07 US disclosed
CN-1037334-A Pyridine derivate MERCK PATENT GMBH (DE) 1989-11-22 CN disclosed