SCHEMBL7981400

SCHEMBL7981400

C[C](C)C1CCCCC1=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
MCL1 Q07820 1/20 0.50
KMT2A Q03164 1/20 0.48
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.40
TLR4 O00206 4/20 0.35
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 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
SCHEMBL63339 0.84 MCL1 (0.53) CA1CA2CA4MCL1KMT2A
SCHEMBL31387265 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL11664151 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL28643556 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL15364870 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL6914585 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL11114524 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
Zinc Ion SCHEMBL31034477 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A
SCHEMBL6345547 0.82 MCL1 (0.47) CA1CA2CA4MCL1KMT2A
SCHEMBL29010313 0.82 MCL1 (0.52) CA1CA2CA4MCL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6280900-B1 RADIATION SENSITIVE COMPOSITION WITH ALKALINE DEVELOPER SOLUBLE IN POLYMER COATED ON SUBSTRATE JSR CORPORATION (JP) 2001-08-28 US claimed
US-6280900-B1 RADIATION SENSITIVE COMPOSITION WITH ALKALINE DEVELOPER SOLUBLE IN POLYMER COATED ON SUBSTRATE JSR CORPORATION (JP) 2001-08-28 US disclosed