SCHEMBL8209459

SCHEMBL8209459

OP(O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
MMP3 P08254 1/20 0.50
BCL2L1 Q07817 1/20 0.50
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MGLL Q99685 1/20 0.44
TAAR1 Q96RJ0 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALOX5 P09917 1/20 0.42
PTPN1 P18031 1/20 0.41
PTPN11 Q06124 1/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
WDR5 P61964 1/20 0.41
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39

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
Biphenyl SCHEMBL9777391 0.92 ALDH1A1 (0.53) ALDH1A1MMP3BCL2L1CA1CA2
SCHEMBL4434791 0.88 ESR1 (0.39) ALDH1A1MMP3BCL2L1CYP3A4TDP1
SCHEMBL28501911 0.88 ESR1 (0.39) ALDH1A1MMP3BCL2L1CYP3A4TDP1
SCHEMBL641890 0.82
SCHEMBL912414 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1
SCHEMBL912568 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1
SCHEMBL28772165 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1
SCHEMBL11861848 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1
Hydrochloric Acid SCHEMBL6673110 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1
SCHEMBL911353 0.79 TDP1 (0.50) ALDH1A1CA1CA2HSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102333768-B diene compound, epoxy resin and composition thereof NIPPON KAYAKU KK 2014-11-12 CN disclosed
CN-102648244-B Polycarboxylic acid composition, process for preparation thereof, and curable resin compositions containing the polycarboxylic acid composition NIPPON KAYAKU KK 2014-05-07 CN disclosed
CN-102791760-A Curable resin composition and cured product thereof NIPPON KAYAKU KK 2012-11-21 CN disclosed
CN-102782014-A Process for production of organopolysiloxane, organopolysiloxane obtained by the process, and composition that contains the organopolysiloxane NIPPON KAYAKU KK 2012-11-14 CN disclosed
CN-102686633-A Epoxy resin composition NIPPON KAYAKU KK 2012-09-19 CN disclosed
CN-102648244-A Polycarboxylic acid composition, process for preparation thereof, and curable resin compositions containing the polycarboxylic acid composition NIPPON KAYAKU KK 2012-08-22 CN disclosed
CN-102574983-A Curable resin composition and cured products thereof NIPPON KAYAKU KK 2012-07-11 CN disclosed
CN-102333768-A Diene compound, epoxy resin and composition thereof NIPPON KAYAKU KK 2012-01-25 CN disclosed
US-7960392-B2 Nitrogen-containing heterocyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2011-06-14 US disclosed
US-20100029690-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2010-02-04 US disclosed
EP-1007586-A1 RHEOLOGY MODIFICATION OF LOW DENSITY POLYETHYLENE THE DOW CHEMICAL COMPANY (US) 2000-06-14 EP disclosed
WO-1999010422-A1 RHEOLOGY MODIFICATION OF LOW DENSITY POLYETHYLENE THE DOW CHEMICAL COMPANY (US) 1999-03-04 WO disclosed
EP-0036278-B1 POLYPHENYLENE ETHER RESIN COMPOSITION OF IMPROVED HEAT STABILITY AND SHAPED ARTICLES THEREOF MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1985-06-19 EP disclosed
EP-0036278-A1 Polyphenylene ether resin composition of improved heat stability and shaped articles thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1981-09-23 EP 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 (1 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-20100029690-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS PTGER1, PTGS1, PTGER2 ALDH1A1 164/4885MMP3 2278/4885BCL2L1 3104/4885

“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.