SCHEMBL140223

SCHEMBL140223

C#Cc1ccc(-c2ccncc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.71
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.55
KEAP1 Q14145 1/20 0.48
NOTUM Q6P988 1/20 0.46
KIF11 P52732 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
QDPR P09417 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK14 Q16539 2/20 0.39
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
EIF4H Q15056 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
EGLN2 Q96KS0 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL139430 0.84
SCHEMBL139848 0.84 HDAC8 (0.50) HDAC8KEAP1KIF11EGLN2CA12
SCHEMBL139611 0.84 HDAC8 (0.50) HDAC8KEAP1KIF11EGLN2CA12
Hydrochloric Acid SCHEMBL1190733 0.81
SCHEMBL10481156 0.81 HDAC8 (0.48) HDAC8KEAP1KIF11EGLN2CA12
Water SCHEMBL11190539 0.81 HDAC8 (0.48) HDAC8KEAP1KIF11EGLN2CA12
SCHEMBL30718530 0.79 MAPT (0.61) HDAC8MAPTLMNANOTUMKIF11
SCHEMBL10000032 0.78 MAPT (0.92) HDAC8MAPTLMNANOTUMKIF11
SCHEMBL135626 0.78 MAPT (0.92) HDAC8MAPTLMNANOTUMKIF11
SCHEMBL13219274 0.77 MAPT (0.58) HDAC8MAPTLMNANOTUMKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285662-A Chitosan bipyridine quaternary ammonium salt and preparation method thereof 南京仁为医药科技有限公司 2023-12-26 CN claimed
CN-119925380-A N-heterocyclic carbene-gold (I) -benzyne complex and antibacterial application thereof 中山大学 2025-05-06 CN disclosed
CN-117285662-A Chitosan bipyridine quaternary ammonium salt and preparation method thereof 南京仁为医药科技有限公司 2023-12-26 CN disclosed
CN-110563531-B Synthetic method of 1, 2-disubstituted olefin compound 浙江工业大学 2022-06-21 CN disclosed
EP-2433131-B1 Particles for long wavelength SERS, method of manufacture and method for tagging a material SICPA HOLDING SA (CH) 2016-07-06 EP disclosed
US-9239327-B2 Particles comprising hollow surface-enhanced spectroscopy (SES)-active core for long wavelength SERS SICPA HOLDING SA (CH) 2016-01-19 US disclosed
US-8791261-B2 Polyhedraltransition metal complex, transition metal complex containing ultrafine particles therein, and process for producing same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-07-29 US disclosed
US-8791261-B2 Polyhedraltransition metal complex, transition metal complex containing ultrafine particles therein, and process for producing same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-07-29 US disclosed
US-8791261-B2 Polyhedraltransition metal complex, transition metal complex containing ultrafine particles therein, and process for producing same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-07-29 US disclosed
US-20120095196-A1 POLYHEDRALTRANSITION METAL COMPLEX, TRANSITION METAL COMPLEX CONTAINING ULTRAFINE PARTICLES THEREIN, AND PROCESS FOR PRODUCING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-19 US disclosed
US-20120095196-A1 POLYHEDRALTRANSITION METAL COMPLEX, TRANSITION METAL COMPLEX CONTAINING ULTRAFINE PARTICLES THEREIN, AND PROCESS FOR PRODUCING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-19 US disclosed
US-20120095196-A1 POLYHEDRALTRANSITION METAL COMPLEX, TRANSITION METAL COMPLEX CONTAINING ULTRAFINE PARTICLES THEREIN, AND PROCESS FOR PRODUCING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-04-19 US disclosed
EP-2433131-A1 PARTICLES AND METHODS FOR LONG WAVELENGTH SERS Cabot Security Materials Inc. (US) 2012-03-28 EP disclosed
US-20120057165-A1 Particles and Methods for Long Wavelength SERS CABOT SECURITY MATERIALS INC. (US) 2012-03-08 US disclosed
WO-2010135354-A1 PARTICLES AND METHODS FOR LONG WAVELENGTH SERS OXONICA MATERIALS INC. (US) 2010-11-25 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-20120095196-A1 POLYHEDRALTRANSITION METAL COMPLEX, TRANSITION METAL COMPLEX CONTAINING ULTRAFINE PARTICLES THEREIN, AND PROCESS FOR PRODUCING SAME FTH1, PCBP1, PUF60 HDAC8 4412/4885MAPT 829/4885LMNA 2352/4885

“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.