SCHEMBL742971

SCHEMBL742971

ClCCCc1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.56
LOXL2 Q9Y4K0 2/20 0.52
HRH3 Q9Y5N1 3/20 0.47
HRH4 Q9H3N8 2/20 0.47
NAAA Q02083 1/20 0.46
CYP3A4 P08684 5/20 0.42
CYP2D6 P10635 4/20 0.42
CYP2C9 P11712 4/20 0.42
CYP1A2 P05177 4/20 0.42
CYP2C19 P33261 3/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HIF1A Q16665 1/20 0.41
NPC1 O15118 1/20 0.40
KMT2A Q03164 1/20 0.40

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
Hydrochloric Acid SCHEMBL1869293 0.98 HRH1 (0.54) HRH1LOXL2HRH3HRH4NAAA
SCHEMBL2959972 0.93 HRH1 (0.59) HRH1LOXL2HRH3HRH4NAAA
SCHEMBL7417903 0.91 HRH1 (0.63) HRH1LOXL2HRH3HRH4NAAA
Hydrochloric Acid SCHEMBL2892360 0.91 HRH1 (0.57) HRH1LOXL2HRH3HRH4NAAA
SCHEMBL9466820 0.91 HRH1 (0.63) HRH1LOXL2HRH3HRH4NAAA
SCHEMBL2551287 0.84
SCHEMBL726645 0.84 HRH1 (0.73) HRH1LOXL2HRH3HRH4NAAA
SCHEMBL351920 0.84 HRH1 (0.65) HRH1LOXL2HRH3HRH4NAAA
Hydrochloric Acid SCHEMBL1677468 0.82 LOXL2 (0.54) HRH1LOXL2HRH3HRH4CYP3A4
SCHEMBL10386360 0.82 HRH1 (0.53) HRH1NAAACYP3A4ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4393939-A Clay stabilization during oil and gas well cementing operations HALLIBURTON SERVICES (US) 1983-07-19 US claimed
US-20240018125-A1 CYCLIC ISOTHIOUREA DERIVATIVES AS CXCR4 MODULATORS ERMIUM THERAPEUTICS (FR) 2024-01-18 US disclosed
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 US disclosed
CN-103732589-B Can be used as the sulphonamide of the replacement of anti-apoptotic BCL inhibitor BRISTOL-MYERS SQUIBB CO. (US) 2016-03-30 CN disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 EP disclosed
US-8765739-B2 Azetidine compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2014-07-01 US disclosed
US-8765739-B2 Azetidine compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2014-07-01 US disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 US disclosed
US-8372981-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-12 US disclosed
US-8372981-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-12 US disclosed
EP-0101381-A1 Anorexic trifluoromethyl phenyl tetrahydropyridines, process for their preparation and pharmaceutical compositions containing them SANOFI S.A. (FR) 1984-02-22 EP disclosed
US-4409110-A MIXTURE OF POLYMERIC VISCOSIFIER AND POLYCATIONIC POLYMER HALLIBURTON COMPANY (US) 1983-10-11 US disclosed
US-4393939-A Clay stabilization during oil and gas well cementing operations HALLIBURTON SERVICES (US) 1983-07-19 US disclosed
US-4374739-A CATIONIC POLYMERS FOR STABILIZATION HALLIBURTON COMPANY (US) 1983-02-22 US disclosed
EP-0068386-A1 Substituted imidazo(1,5-a)pyridines, process for their preparation and pharmaceutical preparations containing these compounds CIBA-GEIGY AG (CH) 1983-01-05 EP disclosed
US-4366072-A ORGANIC POLYCATIONIC POLYMER CONTAINING PHOSPHONIUM GROUPS TO STABILIZE CLAY AGAINST SWELLING HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
US-4366071-A Oil well treating method and composition HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
US-4366074-A Oil well treating method and composition HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
US-4366073-A ORGANIC POLYCATIONIC POLYMER CONTAINING SULFONIUM GROUPS TO STABILIZE CLAY AGAINST SWELLING HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
US-4203987-A HYPOTENSIVE AGENTS, ANTISECRETORY AGENTS, ANTIULCER AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1980-05-20 US 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 (2 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-20240018125-A1 CYCLIC ISOTHIOUREA DERIVATIVES AS CXCR4 MODULATORS CXCR4, CXCR1, CXCL12 HRH1 249/4885LOXL2 3329/4885HRH3 349/4885
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BCL2, BAX, BCL2A1 HRH1 4306/4885LOXL2 3250/4885HRH3 4398/4885

“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.