SCHEMBL11836751

SCHEMBL11836751

CCOC(=O)Cc1ccc(-c2ccccc2)cc1OCCl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ESR1 P03372 1/20 0.42
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
PKM P14618 2/20 0.41
SLC2A2 P11168 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
TBXAS1 P24557 1/20 0.41
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ACLY P53396 1/20 0.40

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
SCHEMBL25913045 0.91 L3MBTL1 (0.49) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL21438503 0.85 RECQL (0.46) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL11839396 0.84 CFD (0.47) LMNA
SCHEMBL11841370 0.83 L3MBTL1 (0.46) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL6862344 0.82 L3MBTL1 (0.49) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL11845894 0.81 MAPT (0.45) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL21455995 0.80 L3MBTL1 (0.42) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL21439302 0.80 PKM (0.49) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL21455784 0.79 L3MBTL1 (0.41) L3MBTL1ALDH1A1KDM4EMAPTHPGD
SCHEMBL6277682 0.78 RXRA (0.51) L3MBTL1ALDH1A1KDM4EMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3941821-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS WILLIAM H. RORER, INC. (US) 1976-03-02 US disclosed