SCHEMBL2184492

SCHEMBL2184492

O=S(=O)(Nc1nc2ccccc2nc1Nc1ccccc1)c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
MAPK1 P28482 1/20 0.75
POLB P06746 2/20 0.73
GFER P55789 1/20 0.73
MEN1 O00255 7/20 0.71
KMT2A Q03164 7/20 0.71
KDM4E B2RXH2 4/20 0.71
NPSR1 Q6W5P4 2/20 0.65
RXFP1 Q9HBX9 1/20 0.65
HTT P42858 2/20 0.64
CTNNB1 P35222 1/20 0.64
GAA P10253 4/20 0.64
ALDH1A1 P00352 2/20 0.64
HPGD P15428 2/20 0.64
LMNA P02545 1/20 0.64
RECQL P46063 1/20 0.64
CDC25A P30304 1/20 0.62
CDC25B P30305 1/20 0.62
EGFR P00533 1/20 0.62

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
SCHEMBL1792241 0.97 MAPT (0.76) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1791237 0.90 TTR (0.76) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1793147 0.90 MAPT (0.76) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1789659 0.90 TTR (0.76) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1792290 0.90 SMN1; SMN2 (0.70) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL190100 0.90 MEN1 (0.80) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL3135247 0.90 MAPT (0.70) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1790930 0.90 CDC25A (0.77) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL15256408 0.90 MAPT (0.73) MAPTSMN1; SMN2MAPK1POLBGFER
SCHEMBL1791643 0.89 MAPT (0.76) MAPTSMN1; SMN2MAPK1POLBGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230241074-A1 INHIBITORS OF PORCINE REPRODUCTIVE AND RESPIRATORY SYNDROME VIRUS Atomwise Inc. 2023-08-03 US disclosed
US-20230241074-A1 INHIBITORS OF PORCINE REPRODUCTIVE AND RESPIRATORY SYNDROME VIRUS Atomwise Inc. 2023-08-03 US disclosed
US-9949980-B2 Drugs to prevent HPV infection WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2018-04-24 US disclosed
US-20150297602-A1 DRUGS TO PREVENT HPV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-22 US disclosed
US-20140128388-A1 TARGETING AN HIV-1 NEF-HOST CELL KINASE COMPLEX UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2014-05-08 US disclosed
US-20140100215-A1 Methods of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2014-04-10 US disclosed
US-8642584-B2 Method of using PI3K and MEK modulators EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642584-B2 Method of using PI3K and MEK modulators EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642584-B2 Method of using PI3K and MEK modulators EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8541415-B2 Targeting an HIV-1 nef-host cell kinase complex University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2013-09-24 US disclosed
US-20120302545-A1 Method of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2012-11-29 US disclosed
US-20120302545-A1 Method of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2012-11-29 US disclosed
EP-2364974-A1 N-(3-Phenylamino-quinoxalin-2-yl)-benzenesulfonamide derivatives as phosphatidylinositol 3-kinase inhibitors Exelixis, Inc. (US) 2011-09-14 EP disclosed
US-20110190241-A1 TARGETING AN HIV-1 NEF-HOST CELL KINASE COMPLEX UNIVERISTY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2011-08-04 US disclosed
US-20110165220-A1 DRUGS TO PREVENT HPV INFECTION WISCONSIN ALUMNI RESEARCH FOUNDATION 2011-07-07 US disclosed
US-20100075947-A1 Methods of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2010-03-25 US disclosed
US-20100075947-A1 Methods of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2010-03-25 US disclosed
US-20100075947-A1 Methods of Using PI3K and MEK Modulators EXELIXIS, INC. (US) 2010-03-25 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 (8 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-20110165220-A1 DRUGS TO PREVENT HPV INFECTION VHL, PHF13, CDKN1A MAPT 4500/4885SMN1; SMN2 3894/4885MAPK1 1445/4885
US-20100075947-A1 Methods of Using PI3K and MEK Modulators PIK3CA, PIK3CD, PIK3R1 MAPT 4580/4885SMN1; SMN2 4624/4885MAPK1 63/4885
US-20230241074-A1 INHIBITORS OF PORCINE REPRODUCTIVE AND RESPIRATORY SYNDROME VIRUS MAVS, PIGS, SARS1 MAPT 4487/4885SMN1; SMN2 4762/4885MAPK1 2001/4885
US-20140100215-A1 Methods of Using PI3K and MEK Modulators PIK3CA, PIK3CD, PIK3R1 MAPT 4580/4885SMN1; SMN2 4624/4885MAPK1 63/4885
US-20120302545-A1 Method of Using PI3K and MEK Modulators PIK3CA, PIK3CD, PIK3R1 MAPT 4606/4885SMN1; SMN2 4676/4885MAPK1 66/4885
US-20110190241-A1 TARGETING AN HIV-1 NEF-HOST CELL KINASE COMPLEX HCK, DCK, NCK1 MAPT 1585/4885SMN1; SMN2 3731/4885MAPK1 195/4885
US-20150297602-A1 DRUGS TO PREVENT HPV INFECTION VHL, PHF13, CDKN1A MAPT 4500/4885SMN1; SMN2 3894/4885MAPK1 1445/4885
US-20140128388-A1 TARGETING AN HIV-1 NEF-HOST CELL KINASE COMPLEX HCK, DCK, NCK1 MAPT 1549/4885SMN1; SMN2 3725/4885MAPK1 178/4885

“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.