SCHEMBL417290

SCHEMBL417290

c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.54
NOTUM Q6P988 1/20 0.52
PLAU P00749 1/20 0.50
FDPS P14324 1/20 0.47
EGFR P00533 1/20 0.47
PIM1 P11309 1/20 0.46
PIK3CA P42336 1/20 0.46
SMO Q99835 2/20 0.45
CYP19A1 P11511 1/20 0.45
ALDH1A1 P00352 1/20 0.45
GABRA1 P14867 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
TGFBR1 P36897 1/20 0.45
AURKA O14965 1/20 0.43
HSP90AA1 P07900 1/20 0.43
PRKACA P17612 1/20 0.43
ADORA2A P29274 1/20 0.43

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
SCHEMBL4858632 0.98 ASIC3 (0.52) ASIC3NOTUMPLAUFDPSEGFR
Hydrochloric Acid SCHEMBL4868804 0.98 ASIC3 (0.52) ASIC3NOTUMPLAUFDPSEGFR
SCHEMBL2789829 0.98 ASIC3 (0.52) ASIC3NOTUMPLAUFDPSEGFR
Hydrochloric Acid SCHEMBL5171214 0.98 ASIC3 (0.52) ASIC3NOTUMPLAUFDPSEGFR
Water SCHEMBL377289 0.95 ASIC3 (0.50) ASIC3NOTUMPLAUFDPSEGFR
Hydrochloric Acid SCHEMBL4868799 0.95 ASIC3 (0.50) ASIC3NOTUMPLAUFDPSEGFR
SCHEMBL912763 0.93 ASIC3 (0.63) ASIC3NOTUMPLAUPIM1SMO
SCHEMBL29578028 0.93 ASIC3 (0.63) ASIC3NOTUMPLAUPIM1SMO
Pyridine SCHEMBL25197533 0.91 NOTUM (0.56) ASIC3NOTUMPLAUFDPSEGFR
SCHEMBL3194223 0.91 CYP19A1 (0.53) ASIC3NOTUMPLAUFDPSEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119529184-A Polymer microsphere for environment and preparation method thereof 南充嘉源环保科技有限责任公司 2025-02-28 CN claimed
CN-119191978-A Method for synthesizing meta-secondary alkyl substituted aryl carboxylic acid 华南理工大学 2024-12-27 CN claimed
CN-114953672-B Wallboard and preparation process thereof 常州市贝美家居科技有限公司 2023-06-09 CN claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-112480176-A Novel targeted lysosome ruthenium photocatalyst and preparation method and application thereof 中山大学 2021-03-12 CN claimed
CN-111518125-A Organosilane synthesis method based on alkenyl chlorosilane coupling reaction 兰州大学 2020-08-11 CN claimed
US-20170145472-A1 METHOD OF DETECTING HELICASE ACTIVITY HONG KONG BAPTIST UNIVERSITY 2017-05-25 US claimed
US-9193746-B2 Luminescent metal complexes and associated technology BIOTIUM, INC. (US) 2015-11-24 US claimed
EP-2001849-B1 PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2014-11-26 EP claimed
US-20080145526-A1 Luminescent Metal Complexes and Associated Technology BIOTIUM, INC. 2008-06-19 US claimed
EP-0813608-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1997-12-29 EP claimed
EP-0808796-A1 Process for the preparation of hydrogen peroxide ENICHEM S.p.A. (IT) 1997-11-26 EP claimed
EP-0802213-A2 Process for the preparation of copolymers of carbon monoxide and at least one compound containing an alkenyl unsaturation ENICHEM S.p.A. (IT) 1997-10-22 EP claimed
EP-0774479-A2 Process for the preparation of copolymers based on carbon monoxide and at least one compound containing an alkenyl unsaturation ENICHEM S.p.A. (IT) 1997-05-21 EP claimed
US-5589326-A FOR ELECTROCHEMICAL BIOSENSORS BOEHRINGER MANNHEIM CORPORATION (US) 1996-12-31 US claimed
EP-0728791-A1 Process for the preparation of copolymers based on carbon monoxide and at least one compound having an alkenylic unsaturation ENICHEM S.p.A. (IT) 1996-08-28 EP claimed
WO-1996025514-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1996-08-22 WO claimed
US-5439794-A Spectroscopically or photoactively determination when bound to Dna THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1995-08-08 US claimed
WO-1994010182-A1 HIGH RELAXIVITY, PARAMAGNETIC, METAL COMPLEXES FOR MAGNETIC RESONANCE IMAGING MALLINCKRODT MEDICAL, INC. (US) 1994-05-11 WO claimed
US-5157032-A Spectroscopically or photoactively determinable THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1992-10-20 US claimed

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-20080145526-A1 Luminescent Metal Complexes and Associated Technology CLTA, CLTB, CACYBP ASIC3 1034/4885NOTUM 3187/4885PLAU 730/4885

“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.