SCHEMBL1663671

SCHEMBL1663671

O=Cc1ccccc1-c1ncc[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.53
TYRO3 Q06418 1/20 0.53
DYRK1B Q9Y463 1/20 0.53
NISCH Q9Y2I1 2/20 0.48
MTOR P42345 1/20 0.48
ADK P55263 1/20 0.48
IDO1 P14902 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ADRA1A P35348 1/20 0.40
XDH P47989 1/20 0.40
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
ADRA2A P08913 1/20 0.38
TLK2 Q86UE8 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
SCHEMBL38662055 1.00 CSNK1A1 (0.53) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL27987378 0.92 CSNK1A1 (0.50) CSNK1A1TYRO3DYRK1BNISCHMTOR
Alcohol SCHEMBL28226404 0.91 CSNK1A1 (0.49) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL8543220 0.85 CSNK1A1 (0.49) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL10503929 0.82 CSNK1A1 (0.49) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL8542514 0.82 CSNK1A1 (0.49) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL9287236 0.80 NISCH (0.64) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL3767684 0.80 CSNK1A1 (0.41) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL14886257 0.78 NISCH (0.61) CSNK1A1TYRO3DYRK1BNISCHMTOR
SCHEMBL24014343 0.78 F2RL1 (0.46) CSNK1A1TYRO3DYRK1BNISCHMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105859628-B A kind of antimicrobial compound is to N imidazoles benzaldehyde contracting ortho-aminotoluene schiff bases and its preparation method and application 清远职业技术学院 2018-08-07 CN claimed
CN-105457087-B Titanium metal material of complex of iridium modification and its preparation method and application 广西中医药大学 2018-06-29 CN claimed
CN-105288726-B Titanium metal material of ruthenium complex modification and its preparation method and application 广西中医药大学 2018-06-22 CN claimed
CN-105251055-B The method that the antibacterial anti-cancer properties of titania nanotube are improved using complex of iridium 广西中医药大学 2018-06-22 CN claimed
CN-105878236-A Application of p-N-imidazole benzaldehyde o-toluidine Schiff base in resistance to staphylococcus aureus 清远职业技术学院 2016-08-24 CN claimed
CN-105878235-A Application of p-N-imidazole benzaldehyde o-toluidine Schiff base in resistance to salmonella 清远职业技术学院 2016-08-24 CN claimed
CN-105859628-A Antimicrobial compound p-N imidazole benzaldehyde condensed ortho-toluidine Schiff base and preparation method and application thereof 清远职业技术学院 2016-08-17 CN claimed
CN-105457087-A Titanium metal material modified by iridium complexes and preparation method and application thereof UNIV GUANGXI CHINESE MEDICINE 2016-04-06 CN claimed
CN-105288726-A Ruthenium coordination compound modified titanium metal material, preparation method and uses thereof UNIV GUANGXI CHINESE MEDICINE 2016-02-03 CN claimed
CN-105251055-A Method for improving antibacterial and anticancer performance of titanium dioxide nanotube by means of iridium complex UNIV GUANGXI CHINESE MEDICINE 2016-01-20 CN claimed
CN-100590120-C Method of synthesizing p-N-imidazolyl benzaldehyde QINGYUAN PROFESSION TECHNOLOGY COLLEGE 2010-02-17 CN claimed
CN-101054365-A Method of synthesizing p-N-imidazolyl benzaldehyde QINGYUAN PROFESSION TECHNOLOGY (CN) 2007-10-17 CN claimed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-105878235-B To application of the N imidazoles benzaldehyde contracting ortho-aminotoluene schiff bases in terms of anti-salmonella 清远职业技术学院 2019-01-15 CN disclosed
US-10131653-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-11-20 US disclosed
CN-105878236-B To application of the N imidazoles benzaldehyde contracting ortho-aminotoluene schiff bases in terms of anti-Staphylococcus aureus 清远职业技术学院 2018-10-26 CN disclosed
EP-1660011-A2 ARYL, HETEROAROMATIC AND BICYCLIC ARYL NITRONE COMPOUNDS, PRODRUGS AND PHARMACEUTICAL COMPOSITIONS OF THE SAME TO TREAT HUMAN DISORDERS Renovis, Inc. (US) 2006-05-31 EP disclosed
WO-2005016272-A2 ARYL, HETEROAROMATIC AND BICYCLIC ARYL NITRONE COMPOUNDS, PRODRUGS AND PHARMACEUTICAL COMPOSITIONS OF THE SAME TO TREAT HUMAN DISORDERS RENOVIS, INC. (US) 2005-02-24 WO disclosed
EP-0857171-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1998-08-12 EP disclosed
WO-1997015555-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1997-05-01 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 (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-10131653-B2 Heterocyclic compound HCRTR1, HCRTR2, OXTR CSNK1A1 2326/4885TYRO3 1528/4885DYRK1B 2944/4885

“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.