SCHEMBL70005

SCHEMBL70005

Oc1ccc2ccccc2c1Oc1c(O)ccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.58
POLB P06746 1/20 0.54
HSD17B10 Q99714 3/20 0.52
CYP1A2 P05177 2/20 0.52
USP2 O75604 1/20 0.52
PAK1 Q13153 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
MAPT P10636 4/20 0.48
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 3/20 0.48
GAA P10253 3/20 0.48
TAAR1 Q96RJ0 1/20 0.48
ERN1 O75460 1/20 0.48
TDP1 Q9NUW8 3/20 0.48
CYP2A6 P11509 1/20 0.48
TSHR P16473 1/20 0.48
IDO1 P14902 1/20 0.46
GLA P06280 1/20 0.44
HPGD P15428 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
SCHEMBL10953383 0.90 HPRT1 (0.56) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL5992678 0.88 KDM4E (0.50) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL7537602 0.85 LTA4H (0.48) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL21821223 0.85 PTPN22 (0.47) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL1402558 0.83 PTPN22 (0.55) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL3818138 0.83 ESR1 (0.54) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL10956772 0.81 ALOX5 (0.43) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL9642819 0.79 PTPN22 (0.50) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL12551096 0.79 PTPN22 (0.50) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL10236585 0.79 PTPN22 (0.50) PTPN22POLBHSD17B10CYP1A2USP2

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-4533766-A Process for the production of dihydroxybenzenes DEGUSSA AKTIENGESELLSCHAFT (DE) 1985-08-06 US claimed
US-20130302990-A1 ORGANIC FILM COMPOSITION, METHOD FOR FORMING ORGANIC FILM AND PATTERNING PROCESS USING THIS, AND HEAT-DECOMPOSABLE POLYMER SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-11-14 US disclosed
US-20130302990-A1 ORGANIC FILM COMPOSITION, METHOD FOR FORMING ORGANIC FILM AND PATTERNING PROCESS USING THIS, AND HEAT-DECOMPOSABLE POLYMER SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-11-14 US disclosed
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 PTPN22 3432/4885POLB 3973/4885HSD17B10 2777/4885

“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.