SCHEMBL16601102

SCHEMBL16601102

CCOP(=O)(CC(=O)COc1ccccc1)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.49
PLA2G4B P0C869 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 1/20 0.44
ALPL P05186 1/20 0.44
ALPI P09923 1/20 0.44
ALPG P10696 1/20 0.44
TSHR P16473 1/20 0.44
MAPK10 P53779 1/20 0.44
HTT P42858 1/20 0.43
HPGD P15428 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL4939704 0.86 ALOX15 (0.47) ALOX15PLA2G4BSMN1; SMN2NPC1RAB9A
SCHEMBL244446 0.84 ALOX15 (0.52) ALOX15SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL9303147 0.83 ALOX15 (0.50) ALOX15SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL16383050 0.82 ALOX15 (0.57) ALOX15MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL1345641 0.78 ALOX15 (0.57) ALOX15PLA2G4BNPC1RAB9AKMT2A
SCHEMBL6915874 0.78 MAPK1 (0.48) MAPTMAPK1SMN1; SMN2POLBTSHR
SCHEMBL10894517 0.78 ELANE (0.45) MAPTMAPK1KMT2AMEN1POLB
SCHEMBL9055584 0.76 CYP2C9 (0.55) MAPTMAPK1POLBCYP2C9CYP2C19
SCHEMBL11822210 0.76 PLA2G4B (0.55) PLA2G4BMAPTMAPK1SMN1; SMN2NPC1
SCHEMBL464497 0.76 ALOX15 (0.63) ALOX15PLA2G4BSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10100028-B2 Synthesis routes for prostaglandins and prostaglandin intermediates using metathesis PATHEON API SERVICES INC. (US) 2018-10-16 US disclosed
US-20160237056-A1 NOVEL SYNTHESIS ROUTES FOR PROSTAGLANDINS AND PROSTAGLANDIN INTERMEDIATES USING METATHESIS PATHEON API SERVICES INC. 2016-08-18 US disclosed
WO-2015048736-A1 NOVEL SYNTHESIS ROUTES FOR PROSTAGLANDINS AND PROSTAGLANDIN INTERMEDIATES USING METATHESIS IRIX PHARMACEUTICALS, INC. (US) 2015-04-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160237056-A1 NOVEL SYNTHESIS ROUTES FOR PROSTAGLANDINS AND PROSTAGLANDIN INTERMEDIATES USING METATHESIS PTGES, PTGIS, PTGES2 ALOX15 24/4885PLA2G4B 52/4885MAPT 4437/4885
US-10100028-B2 Synthesis routes for prostaglandins and prostaglandin intermediates using metathesis PTGES, PTGIS, PTGES2 ALOX15 25/4885PLA2G4B 58/4885MAPT 4497/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.