SCHEMBL17254903

SCHEMBL17254903

N#Cc1cc2ccc(Cl)nc2n2c1nc1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.49
▸ ALDH1A1 P00352 6/20 0.49
▸ MAPT P10636 5/20 0.49
▸ NPSR1 Q6W5P4 5/20 0.49
▸ GAA P10253 4/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ POLB P06746 3/20 0.49
▸ GLA P06280 1/20 0.49
▸ XBP1 P17861 1/20 0.49
▸ KMT2A Q03164 7/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ HPGD P15428 3/20 0.44
▸ TSHR P16473 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ RAB9A P51151 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MDM2 Q00987 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42

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
SCHEMBL21208463 0.81 HPGD (0.43) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL18042578 0.76 KDM4E (0.49) KDM4EALDH1A1MAPTGAAGLA
SCHEMBL6310567 0.75 KDM4E (0.50) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL15579203 0.74 KDM4E (0.56) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL17255009 0.74 KDM4E (0.54) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL17255069 0.74 KDM4E (0.57) KDM4EALDH1A1MAPTGAAPOLB
SCHEMBL17255029 0.74 HRH3 (0.52) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL31403195 0.74 TSHR (0.40) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL17255024 0.74 TSHR (0.40) KDM4EALDH1A1MAPTNPSR1GAA
SCHEMBL29587846 0.73 KDM4E (0.51) KDM4EALDH1A1MAPTNPSR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317120-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2021-10-14 — — US disclosed
US-20210094952-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2021-04-01 — — US disclosed
US-20200361937-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2020-11-19 — — US disclosed
US-10745403-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-08-18 — — US disclosed
US-10590134-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-03-17 — — US disclosed
US-10442801-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2019-10-15 — — US disclosed
US-9951066-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2018-04-24 — — US disclosed
EP-3140305-B1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM PIMERA INC (US) 2018-04-18 — — EP disclosed
US-20180079750-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2018-03-22 — — US disclosed
US-20170334905-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2017-11-23 — — US disclosed
EP-3219716-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM Pimera, Inc. (US) 2017-09-20 — — EP disclosed
US-9758518-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2017-09-12 — — US disclosed
US-9758518-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2017-09-12 — — US disclosed
US-9512123-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2016-12-06 — — US disclosed
US-9512123-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2016-12-06 — — US disclosed
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them PIMERA, INC 2016-11-10 — — US disclosed
US-20160326176-A1 Novel Compositions, Uses and Methods for Making Them PIMERA, INC 2016-11-10 — — US disclosed
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2016-09-08 — — US disclosed
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2016-09-08 — — US disclosed
WO-2015172123-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM HADDACH MUSTAPHA (US) 2015-11-12 — — 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 (10 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-20160326176-A1 Novel Compositions, Uses and Methods for Making Them BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-10590134-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885ALDH1A1 3165/4885MAPT 4126/4885
US-20180079750-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-10745403-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885ALDH1A1 3165/4885MAPT 4126/4885
US-20200361937-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-20170334905-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-20210317120-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, CASP7 KDM4E 2459/4885ALDH1A1 2282/4885MAPT 4128/4885
US-20160257678-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-20210094952-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 KDM4E 2839/4885ALDH1A1 3544/4885MAPT 4105/4885
US-10442801-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 KDM4E 2323/4885ALDH1A1 3165/4885MAPT 4126/4885

“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.

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