SCHEMBL4539343

SCHEMBL4539343

O=C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O)NO

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 9/20 0.58
▸ HDAC2 Q92769 9/20 0.58
▸ HDAC3 O15379 8/20 0.58
▸ HDAC8 Q9BY41 8/20 0.58
▸ HDAC6 Q9UBN7 8/20 0.58
▸ HDAC5 Q9UQL6 8/20 0.58
▸ TPI1 P60174 1/20 0.53
▸ LPAR3 Q9UBY5 5/20 0.52
▸ LPAR2 Q9HBW0 5/20 0.52
▸ LPAR1 Q92633 4/20 0.52
▸ HSP90AA1 P07900 1/20 0.48
▸ ENPP2 Q13822 1/20 0.47
▸ HDAC4 P56524 7/20 0.46
▸ HDAC7 Q8WUI4 7/20 0.46
▸ HDAC10 Q969S8 7/20 0.46
▸ HDAC11 Q96DB2 7/20 0.46
▸ HDAC9 Q9UKV0 7/20 0.46

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
SCHEMBL4527758 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4528782 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4522285 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4533046 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4532834 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4521729 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4539071 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4536068 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4516679 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL4528520 1.00 HDAC1 (0.58) HDAC1HDAC2HDAC3HDAC8HDAC6

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-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 — — US disclosed
WO-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 — — WO disclosed
Send feedback