SCHEMBL38628

SCHEMBL38628

[c]1nc2c(-c3cc4ccccc4o3)cccc2o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
MAOA P21397 3/20 0.51
RAB9A P51151 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PTPRC P08575 1/20 0.41
PTPN1 P18031 1/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 1/20 0.41
PDE4D Q08499 1/20 0.40
ADRA2A P08913 2/20 0.40
METAP2 P50579 1/20 0.40
HTR2C P28335 1/20 0.40
GRM4 Q14833 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
HPGD P15428 1/20 0.39
ADRA2B P18089 1/20 0.39

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
SCHEMBL3222732 0.78 ALDH1A1 (0.30) ALDH1A1HSD17B10
SCHEMBL7131658 0.78
SCHEMBL6051921 0.76 ALDH1A1 (0.41) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL1377576 0.75 MAOB (0.48) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL1136612 0.75 MAOB (0.48) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL61411 0.74 MAOB (0.71) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL12854020 0.74 MAOB (0.71) MAOBMAOARAB9AMEN1KMT2A
SCHEMBL8956841 0.74 ENPP1 (0.34) MAOBRAB9AMEN1KMT2AMETAP2
SCHEMBL3230996 0.74 DYRK1A (0.33) BRD4
SCHEMBL3215613 0.73 KIT (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269748-A1 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2011-11-03 US claimed
CN-101291582-A Novel imidazo based heterocycles ABBOTT LAB (US) 2008-10-22 CN claimed
EP-1926719-A2 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-04 EP claimed
WO-2007031440-A2 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-22 WO claimed
CN-1658873-A New pharmaceutical compositions based on anticholinergics and p38 kinase inhibitors BOEHRINGER INGELHEIM PHARMA (DE) 2005-08-24 CN claimed
CN-1658834-A Method of treating mucus hypersecretion BOEHRINGER INGELHEIM PHARMA (DE) 2005-08-24 CN claimed
CN-118184702-A Antiviral prodrugs and uses thereof 上海柯君医药科技有限公司 2024-06-14 CN disclosed
EP-3271015-A1 NK-3 RECEPTOR ANTAGONISTS FOR THERAPEUTIC OR COSMETIC TREATMENT OF EXCESS BODY FAT OGEDA S.A. (BE) 2018-01-24 EP disclosed
EP-1926719-B1 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2017-05-31 EP disclosed
WO-2016146712-A1 NK-3 RECEPTOR ANTAGONISTS FOR THERAPEUTIC OR COSMETIC TREATMENT OF EXCESS BODY FAT EUROSCREEN SA (BE) 2016-09-22 WO disclosed
US-9388175-B2 2-aniline-4-aryl substituted thiazole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2016-07-12 US disclosed
EP-2655344-A1 NOVEL PHENAZINE DERIVATIVES AND THEIR USE Université Catholique de Louvain (BE) 2013-10-30 EP disclosed
CN-103271906-A Use of spiro-oxindole compounds as therapeutic agents XENON PHARMACEUTICALS INC 2013-09-04 CN disclosed
CN-101454004-A Pyridone sulfonamides and pyridone sulfamides as mek inhibitors ARDEA BIOSCIENCES INC (US) 2009-06-10 CN disclosed
CN-101355968-A Compositions and methods for treating thrombocytopenia ASTELLAS PHARMA INC (JP) 2009-01-28 CN disclosed
CN-101291582-A Novel imidazo based heterocycles ABBOTT LAB (US) 2008-10-22 CN disclosed
EP-1926719-A2 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-04 EP disclosed
WO-2007031440-A2 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-22 WO disclosed
CN-1658834-A Method of treating mucus hypersecretion BOEHRINGER INGELHEIM PHARMA (DE) 2005-08-24 CN disclosed
CN-1658873-A New pharmaceutical compositions based on anticholinergics and p38 kinase inhibitors BOEHRINGER INGELHEIM PHARMA (DE) 2005-08-24 CN 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-20110269748-A1 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES CHRNA4, CHRNA5, CHRNA7 MAOB 614/4885MAOA 451/4885RAB9A 3437/4885

“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.