SCHEMBL18363045

SCHEMBL18363045

Cc1ccc(COOCCOP(=O)(O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 6/20 0.42
S1PR3 Q99500 4/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 2/20 0.41
AGXT P21549 2/20 0.40
BTN3A1 O00481 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
MAOB P27338 1/20 0.37
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.37
PARP10 Q53GL7 1/20 0.36

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
SCHEMBL207268 0.82 RAB9A (0.53) S1PR1S1PR3RAB9ANPC1AGXT
SCHEMBL13395489 0.79 S1PR1 (0.46) S1PR1S1PR3BTN3A1TSHRLMNA
SCHEMBL958300 0.75 AGXT (0.64) RAB9ANPC1AGXTCA1CA2
SCHEMBL9138537 0.74 TSHR (0.64) S1PR1S1PR3RAB9ANPC1AGXT
SCHEMBL13988111 0.74 L3MBTL1 (0.53) NPC1ALDH1A1MAPK1TSHR
SCHEMBL3939048 0.73 LPAR3 (0.48)
SCHEMBL13057594 0.72 ACHE (0.62) RAB9ANPC1AGXTCA1CA2
SCHEMBL17345002 0.71 TSHR (0.58) S1PR1S1PR3RAB9ANPC1TSHR
Phosphoric Acid Monotetradecyl Ester SCHEMBL28092995 0.69 LPAR3 (0.75) S1PR1S1PR3
SCHEMBL18363047 0.69 TDP1 (0.54) RAB9ANPC1ALDH1A1MAPTLMNA

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-20170012151-A1 MULTILAYER TRANSPARENT POLYESTER FILM, METHOD FOR MANUFACTURING SAID FILM AND USE OF SAID FILM IN PARTICULAR IN THE BACKSHEETS OF PHOTOVOLTAIC PANELS TORAY FILMS EUROPE (FR) 2017-01-12 US disclosed