SCHEMBL27952952

SCHEMBL27952952

CCCCCCOC(=O)/C=C/C(=O)OCc1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.54
▸ HCAR2 Q8TDS4 3/20 0.54
▸ ATM Q13315 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ TSHR P16473 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ AKR1B10 O60218 2/20 0.48
▸ AKR1B1 P15121 2/20 0.48
▸ TP53 P04637 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL27952953 1.00 APP (0.54) APPHCAR2ATMALDH1A1TSHR
SCHEMBL21678782 0.94 ATM (0.57) APPHCAR2ATMALDH1A1TSHR
SCHEMBL21678750 0.89 APP (0.50) APPHCAR2ATMALDH1A1TSHR
SCHEMBL2340792 0.84 HCAR2 (0.53) HCAR2TSHRLMNAAKR1B10AKR1B1
SCHEMBL78103 0.84 HCAR2 (0.53) HCAR2TSHRLMNAAKR1B10AKR1B1
SCHEMBL21678700 0.83 MAPT (0.52) HCAR2ALDH1A1LMNAAKR1B10AKR1B1
SCHEMBL5654912 0.82 HCAR2 (0.62) APPHCAR2ATMALDH1A1TSHR
Phenol SCHEMBL7865588 0.81 HCAR2 (0.74) APPHCAR2ATMALDH1A1TSHR
SCHEMBL21678773 0.80 AKR1B1 (0.47) APPHCAR2ALDH1A1LMNAAKR1B10
SCHEMBL7771761 0.80 APP (0.62) APPHCAR2ATMALDH1A1TSHR

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
CN-103658097-B Cleaning method 佐敦集团 2017-03-01 — — CN disclosed
CN-103658097-A Cleaning process JOTUN AS 2014-03-26 — — CN disclosed
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