SCHEMBL1502065

SCHEMBL1502065

O=C(Oc1ccccc1)n1cnnn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.50
BCHE P06276 1/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
NOTUM Q6P988 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CHRNA7 P36544 1/20 0.39
HTR3A P46098 1/20 0.39
MGLL Q99685 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL28492827 0.77 KMT2A (0.51) KMT2AMEN1LMNANOTUMSMN1; SMN2
SCHEMBL918756 0.73 NOTUM (0.47) KMT2AGAAMEN1NOTUMSMN1; SMN2
SCHEMBL25412576 0.70 ELANE (0.46) BCHEGAAALDH1A1
Biphenyl SCHEMBL2202263 0.70 NOTUM (0.44) KMT2AGAAMEN1NOTUMSMN1; SMN2
SCHEMBL28619407 0.69 KMT2A (0.73) KMT2AMEN1LMNANOTUMSMN1; SMN2
SCHEMBL3079013 0.69 TP53 (0.54) KMT2ABCHEGAAMEN1SMN1; SMN2
SCHEMBL13689910 0.69 BCHE (0.41) KMT2ABCHEGAAMEN1LMNA
SCHEMBL11030328 0.69 GAA (0.44) KMT2ABCHEGAAMEN1LMNA
SCHEMBL4502875 0.68
SCHEMBL753707 0.68 GAA (0.43) KMT2ABCHEGAAMEN1LMNA

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928311-B1 SHAPING OBJECT WITH REACTIVE FUNCTIONS BIOTECHNOLOG FORSCHUNG GMBH (DE) 2003-04-09 EP claimed
WO-2020128525-A1 NRTI THERAPIES THE UNIVERSITY OF LIVERPOOL (GB) 2020-06-25 WO disclosed
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors TRANA DISCOVERY, INC. (US) 2019-06-11 US disclosed
CN-102015697-B Amide derivatives and pharmaceutical compositions containing the same DAINIPPON SUMITOMO PHARMA CO 2015-06-17 CN disclosed
EP-2256114-B1 AMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME DAINIPPON SUMITOMO PHARMA CO (JP) 2014-06-25 EP disclosed
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2014-06-12 US disclosed
EP-2691542-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS Trana Discovery, Inc. (US) 2014-02-05 EP disclosed
US-8431341-B2 Compositions and methods for the identification of inhibitors of protein synthesis TRANA DISCOVERY, INC. (US) 2013-04-30 US disclosed
WO-2012135416-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS TRANA DISCOVERY, INC. (US) 2012-10-04 WO disclosed
US-8232378-B2 Compositions and methods for the identification of inhibitors of protein synthesis TRANA DISCOVERY, INC. (US) 2012-07-31 US disclosed
US-20030166930-A1 Process for synthesis of heteroaryl-substituted urea compounds useful as antiinflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-09-04 US disclosed
US-20030166931-A1 Process for synthesis of heteroaryl-substituted urea compounds useful as antiinflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-09-04 US disclosed
US-6583282-B1 Formation of a urea by reacting an aromatic carbamate with a aromatic amine BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-06-24 US disclosed
US-20030109703-A1 Polymorph and process for preparing same BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-06-12 US disclosed
EP-0928311-B1 SHAPING OBJECT WITH REACTIVE FUNCTIONS BIOTECHNOLOG FORSCHUNG GMBH (DE) 2003-04-09 EP disclosed
EP-1200411-A2 NOVEL PROCESS FOR SYNTHESIS OF HETEROARYL-SUBSTITUTED UREA COMPOUNDS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2002-05-02 EP disclosed
US-6294555-B1 SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
EP-1076055-A1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 2001-02-14 EP disclosed
WO-2001004115-A2 NOVEL PROCESS FOR SYNTHESIS OF HETEROARYL-SUBSTITUTED UREA COMPOUNDS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-01-18 WO disclosed
EP-0567841-A2 Fluorescently marked compounds, their preparation and use MERCK PATENT GmbH (DE) 1993-11-03 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 (5 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-20030166931-A1 Process for synthesis of heteroaryl-substituted urea compounds useful as antiinflammatory agents URB2, UGT1A1, PURB KMT2A 3209/4885BCHE 2355/4885GAA 2063/4885
US-20140163037-A1 SCREENING METHODS FOR IDENTIFYING SPECIFIC STAPHYLOCOCCUS AUREUS INHIBITORS NSUN3, RNGTT, TRMT1 KMT2A 1190/4885BCHE 3618/4885GAA 3434/4885
US-20030109703-A1 Polymorph and process for preparing same UGT1A1, CYP1A1, CYP1B1 KMT2A 3719/4885BCHE 3847/4885GAA 1592/4885
US-10316371-B2 Screening methods for identifying specific Staphylococcus aureus inhibitors NSUN3, RNGTT, TRMT1 KMT2A 1190/4885BCHE 3618/4885GAA 3434/4885
US-20030166930-A1 Process for synthesis of heteroaryl-substituted urea compounds useful as antiinflammatory agents URB2, UGT1A1, PURB KMT2A 3209/4885BCHE 2355/4885GAA 2063/4885

“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.