SCHEMBL729591

SCHEMBL729591

O=C(C=Cc1ccccc1)Nc1ccccc1Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 1.00
TP53 P04637 1/20 0.69
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
MMP1 P03956 7/20 0.69
MMP2 P08253 7/20 0.69
MMP9 P14780 7/20 0.69
HDAC3 O15379 1/20 0.62
HDAC4 P56524 1/20 0.62
HDAC1 Q13547 1/20 0.62
HDAC2 Q92769 1/20 0.62
HDAC8 Q9BY41 1/20 0.62
HDAC6 Q9UBN7 1/20 0.62
TRPA1 O75762 1/20 0.62
TRPM8 Q7Z2W7 1/20 0.62
MAOA P21397 2/20 0.62
MAOB P27338 2/20 0.62
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58

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
SCHEMBL729590 1.00 EGFR (1.00) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL5764816 1.00 EGFR (1.00) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL10492426 0.88 MMP1 (0.80) EGFRMAPTMMP1MMP2MMP9
SCHEMBL10492424 0.88 MMP1 (0.80) EGFRMAPTMMP1MMP2MMP9
SCHEMBL3150080 0.86 EGFR (0.76) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL3150070 0.86 EGFR (0.76) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL11859673 0.85 EGFR (0.74) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL11859691 0.85 EGFR (0.74) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL20660618 0.82 EGFR (0.75) EGFRTP53MAPTSMN1; SMN2MMP1
SCHEMBL20660616 0.82 EGFR (0.75) EGFRTP53MAPTSMN1; SMN2MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10807997-B2 Methods for making quinolinyldiamines EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-10-20 US disclosed
US-20200071344-A1 METHODS FOR MAKING QUINOLINYLDIAMINES EXXONMOBIL CHEMICAL PATENTS INC. 2020-03-05 US disclosed
WO-2020046794-A1 METHODS FOR MAKING QUINOLINYLDIAMINES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-03-05 WO disclosed
US-9394297-B2 Amides as pim inhibitors AMGEN INC. (US) 2016-07-19 US disclosed
CN-103214482-B Imidazo [1,2-a] pyridine compounds as receptor tyrosine kinase inhibitors 阵列生物制药公司 2016-06-29 CN disclosed
US-20150329538-A1 AMIDES AS PIM INHIBITORS AMGEN INC. (US) 2015-11-19 US disclosed
WO-2013130660-A1 AMIDES AS PIM INHIBITORS AMGEN INC. (US) 2013-09-06 WO disclosed
EP-2137184-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2013-05-08 EP disclosed
US-8138181-B2 Imidazo[1,2-a]pyridine compounds as receptor tyrosine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2012-03-20 US disclosed
EP-2136807-B1 PYRROLO (3, 2, 1-IJ) QUINOLINE-4-ONE DERIVATIVES FOR TREATING TUBERCULOSIS GLAXO GROUP LTD (GB) 2010-11-03 EP disclosed
EP-1980251-A1 Pyrrolo[3,2,1-ij]quinoline-4-one derivatives for treating tuberculosis GLAXO GROUP LIMITED (GB) 2008-10-15 EP disclosed
WO-2008121687-A2 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-10-09 WO disclosed
US-20080221110-A1 Compounds GLAXO GROUP LIMITED (GB) 2008-09-11 US disclosed
EP-1954697-A2 PERI CONDENSED TRICYCLIC COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2008-08-13 EP disclosed
WO-2007081597-A2 PERI CONDENSED TRICYCLIC COMPOUNDS USEFUL AS ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-07-19 WO disclosed
US-7019147-B1 Benzimidazole derivatives useful as antiproliferative agents PFIZER INC. (US) 2006-03-28 US disclosed
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 EP disclosed
CN-1402721-A Novel benzimidazole derivatives as antiproliferative agents PFIZER PROD INC (US) 2003-03-12 CN disclosed
EP-1235825-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS Pfizer Products Inc. (US) 2002-09-04 EP disclosed
WO-2001040217-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PRODUCTS INC. (US) 2001-06-07 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 (4 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-20080221110-A1 Compounds NRDC, NISCH, MRPL21 EGFR 891/4885TP53 1941/4885MAPT 1138/4885
US-20150329538-A1 AMIDES AS PIM INHIBITORS PIM1, PIM3, PIM2 EGFR 367/4885TP53 129/4885MAPT 3261/4885
US-20200071344-A1 METHODS FOR MAKING QUINOLINYLDIAMINES NNMT, PNMT, HNMT EGFR 3801/4885TP53 2100/4885MAPT 1630/4885
US-10807997-B2 Methods for making quinolinyldiamines NNMT, PNMT, HNMT EGFR 3801/4885TP53 2100/4885MAPT 1630/4885

“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.