SCHEMBL11367180

SCHEMBL11367180

[CH]=CC(=O)COc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.61
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
FFAR1 O14842 1/20 0.50
ALPL P05186 1/20 0.49
ALPI P09923 1/20 0.49
ALPG P10696 1/20 0.49
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MAOB P27338 3/20 0.44
AOC2 O75106 2/20 0.44
MAOA P21397 2/20 0.44
AOC3 Q16853 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
PTPN7 P35236 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
SCHEMBL31172364 0.82 ALOX15 (0.63) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL11008229 0.80 ALOX15 (0.61) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL19783265 0.80 ALOX15 (0.61) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL5497407 0.80 ALOX15 (0.61) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL10656399 0.77 ALOX15 (0.57) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL10561522 0.77 ALOX15 (0.68) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL3898377 0.76 ALOX15 (0.74) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL8127 0.76 ALOX15 (1.00) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL1318870 0.76 ALOX15 (1.00) ALOX15KMT2AMEN1FFAR1ALPL
SCHEMBL9725995 0.76 CYP1A2 (0.61) ALOX15KMT2AMEN1FFAR1ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4304907-A Bicyclo lactone intermediates for prostaglandin analogs THE UPJOHN COMPANY (US) 1981-12-08 US disclosed
US-4303796-A 16-Phenoxy prostaglandin F2α analogs THE UPJOHN COMPANY (US) 1981-12-01 US disclosed
US-4247635-A Microbiological reduction of 15-ketoprostaglandin intermediates SCHERING AKTIENGESELLSCHAFT (DE) 1981-01-27 US disclosed
US-4154950-A PROSTAGLANDIN, WOUND HEALING AGENTS, OXYTOCICS, ANTIULCER AGENTS, ANTICOAGULANT, DECONGESTANT THE UPJOHN COMPANY (US) 1979-05-15 US disclosed
US-4116988-A 16-Phenoxy prostaglandin E1 analogs THE UPJOHN COMPANY (US) 1978-09-26 US disclosed
US-4116989-A 16-Phenoxy prostaglandin F1α analogs THE UPJOHN COMPANY (US) 1978-09-26 US disclosed
US-4087616-A 16-Phenoxy prostaglandin A2 analogs THE UPJOHN COMPANY (US) 1978-05-02 US disclosed
US-4001300-A ANTIULCER, DECONGESTANT, LABOR INDUCER, WOUND HEALER THE UPJOHN COMPANY (US) 1977-01-04 US disclosed