SCHEMBL722146

SCHEMBL722146

CC(C)(C)c1cc(OOP(=O)(Cl)Cl)c2ccccc2c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.37
PTPN1 P18031 2/20 0.35
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPK14 Q16539 2/20 0.33
HTT P42858 1/20 0.32
METAP2 P50579 1/20 0.32
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
TRPV1 Q8NER1 1/20 0.30
NR1I2 O75469 1/20 0.30

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
SCHEMBL722741 0.86 NR1I2 (0.36) NR1I2
SCHEMBL720280 0.85 GPR84 (0.42) GPR84PTPN1ALDH1A1HSD17B10KDM4E
SCHEMBL723710 0.75 HTR1B (0.44) ALDH1A1HSD17B10KDM4EHTTHPGD
SCHEMBL26522379 0.75 NQO1 (0.47) ALDH1A1KDM4EMAPK14HTTMETAP2
SCHEMBL720775 0.71 NR1I2 (0.38) ALDH1A1HSD17B10METAP2HPGDMAPT
SCHEMBL719705 0.69 EGLN1 (0.36) GPR84ALDH1A1HSD17B10KDM4EMAPK14
SCHEMBL23479359 0.68 CYP2A6 (0.45) GPR84ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL22747181 0.67 CYP1A2 (0.59) GPR84ALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL7955337 0.67 ALDH1A1 (0.42) GPR84PTPN1ALDH1A1HSD17B10KDM4E
SCHEMBL10409091 0.66 ALDH1A1 (0.54) ALDH1A1HSD17B10MAPK14HIF1ACYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759318-B2 Phosphoramidate derivatives of guanosine nucleoside compounds for treatment of viral infections INHIBITEX, INC. (US) 2014-06-24 US disclosed
US-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2012-03-01 US disclosed
EP-2385951-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS University College Cardiff Consultants, Ltd. (GB) 2011-11-16 EP disclosed
US-20110254856-A1 MOBILE TERMINAL AND METHOD OF CONTROLLING OPERATION OF THE MOBILE TERMINAL LG ELECTRONICS INC. (KR) 2011-10-20 US disclosed
WO-2010081082-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS UNIVERSITY COLLEGE OF CARDIFF CONSULTANTS LIMITED (GB) 2010-07-15 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 (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-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections PNP, SAMHD1, MTAP GPR84 1977/4885PTPN1 2649/4885ALDH1A1 4139/4885

“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.