SCHEMBL11839196

SCHEMBL11839196

CCOC(=O)Cc1ccc(-c2ccccc2OCCl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ THRB P10828 1/20 0.48
▸ HPGD P15428 2/20 0.46
▸ RXRA P19793 1/20 0.44
▸ RXRB P28702 1/20 0.44
▸ RXRG P48443 1/20 0.44
▸ LMNA P02545 3/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ MAPT P10636 3/20 0.43
▸ GRM2 Q14416 1/20 0.43
▸ MME P08473 1/20 0.42
▸ TRPM8 Q7Z2W7 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP4Z1 Q86W10 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ NFKB1 P19838 1/20 0.42

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
SCHEMBL11837625 0.82 CYP4F2 (0.44) ALDH1A1L3MBTL1THRBHPGDMAPT
SCHEMBL11839428 0.82 MAPT (0.49) ALDH1A1L3MBTL1THRBHPGDMAPT
SCHEMBL11849679 0.81 LMNA (0.56) ALDH1A1L3MBTL1RXRARXRBRXRG
SCHEMBL11837941 0.80 ALDH1A1 (0.50) ALDH1A1L3MBTL1THRBHPGDLMNA
SCHEMBL11844403 0.79 L3MBTL1 (0.43) ALDH1A1L3MBTL1THRBHPGDLMNA
SCHEMBL11727313 0.79 CA12 (0.47) ALDH1A1L3MBTL1THRBHPGDMAPT
SCHEMBL3227634 0.78 GAA (0.58) ALDH1A1L3MBTL1THRBLMNAHTT
SCHEMBL68930 0.77 CYP4Z1 (0.57) ALDH1A1L3MBTL1THRBLMNAMAPT
Hydrochloric Acid SCHEMBL7390203 0.76 L3MBTL1 (0.56) ALDH1A1L3MBTL1THRBLMNAHTT
SCHEMBL11847298 0.76 MAPT (0.51) ALDH1A1L3MBTL1THRBLMNAMAPT

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
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