SCHEMBL7868705

SCHEMBL7868705

CC(C)(COc1ccccc1)NC(=O)CCCCCl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALPL P05186 2/20 0.50
ALPI P09923 2/20 0.50
ALPG P10696 2/20 0.50
HDAC1 Q13547 3/20 0.48
HDAC2 Q92769 3/20 0.48
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 3/20 0.43
NPC1 O15118 2/20 0.42
LMNA P02545 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41

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
SCHEMBL7875151 0.78 TBXAS1 (0.52) MEN1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL7877370 0.77 MTNR1A (0.51) MEN1KMT2AALPLALPIALPG
SCHEMBL7876976 0.72 ALDH1A1 (0.61) MEN1KMT2AALPLALPIALPG
SCHEMBL11817718 0.70 CYP1A2 (0.54) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL13472198 0.69 KMT2A (0.57) MEN1KMT2AALPLALPIALPG
SCHEMBL4644114 0.68 KMT2A (0.56) MEN1KMT2AALPLALPIALPG
SCHEMBL18381487 0.68 HDAC1 (0.71) MEN1KMT2AALPLALPIALPG
SCHEMBL13359839 0.68 CYP2D6 (0.50) ALPLALPIALPGLMNASMN1; SMN2
SCHEMBL3465226 0.67 PPARA (0.47) ALPLALPIALPGMAPTHPGD
SCHEMBL11638411 0.67 HDAC4 (0.69) HDAC1HDAC2KDM4EHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326500-B1 ANTIINFLAMMATORY AGENTS; ANTIALLERGENS ABBOTT LABORATORIES 2001-12-04 US disclosed
US-6215001-B1 ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS, AND ANTIALLERGENS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 2001-04-10 US disclosed
US-6031109-A Phenoxy-, phenylthio-, benzoyl-alkyleneaminoalkylene-imidazole derivatives as therapeutic agents KNOLL AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
US-5780642-A NON-STEROIDAL ANTIINFLAMMATORY AGENT WHICH BLOCKS RELEASE OF ARACHIDONIC ACID FROM PHOSPHOLIPIDS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
EP-0705251-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS Knoll AG (DE) 1996-04-10 EP disclosed
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 WO disclosed