SCHEMBL11515974

SCHEMBL11515974

BrC1=CCCCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
KDM1A O60341 1/20 0.34
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC5 Q9UQL6 1/20 0.30

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
SCHEMBL11514022 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11514017 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11513142 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL2384838 1.00
SCHEMBL11515968 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11513038 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11513040 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11713017 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL11515969 1.00 HDAC4 (0.38) HDAC4HDAC2HDAC8HDAC6KDM1A
SCHEMBL2384839 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4138583-A ANTICOAGULANTS, CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS MILES LABORATORIES, INC. (US) 1979-02-06 US disclosed
US-4138582-A ANTICOAGULANTS, CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS MILES LABORATORIES, INC. (US) 1979-02-06 US disclosed
US-4066834-A Cycloalkenyl analogues of prostaglandins E MILES LABORATORIES, INC. (US) 1978-01-03 US disclosed