SCHEMBL1029106

SCHEMBL1029106

CCN(CCN)c1cccc(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.43
▸ LMNA P02545 3/20 0.43
▸ TSHR P16473 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ USP2 O75604 1/20 0.42
▸ TP53 P04637 3/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ S100B P04271 1/20 0.41
▸ RECQL P46063 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPSR1 Q6W5P4 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
SCHEMBL30197097 1.00 GFER (0.46) GFERALDH1A1CYP3A4TAAR1LMNA
SCHEMBL11775418 0.90 ALDH1A1 (0.46) GFERALDH1A1CYP3A4TAAR1LMNA
SCHEMBL9365623 0.89 ALDH1A1 (0.52) GFERALDH1A1CYP3A4LMNATSHR
Hydrochloric Acid SCHEMBL9437914 0.87 ALDH1A1 (0.50) GFERALDH1A1CYP3A4LMNATSHR
SCHEMBL9644057 0.85 ALDH1A1 (0.48) GFERALDH1A1CYP3A4TAAR1LMNA
SCHEMBL681549 0.85 ALDH1A1 (0.48) GFERALDH1A1CYP3A4LMNATSHR
SCHEMBL11146469 0.85 ALDH1A1 (0.50) GFERALDH1A1CYP3A4LMNATSHR
SCHEMBL7528609 0.85 TAAR1 (0.49) GFERALDH1A1TAAR1LMNATSHR
SCHEMBL457496 0.85 ALDH1A1 (0.61) GFERALDH1A1CYP3A4LMNATSHR
SCHEMBL30565134 0.85 ALDH1A1 (0.61) GFERALDH1A1CYP3A4LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115637057-B Synthesis method of double-crosslinking azo disperse dye 绍兴文理学院 2023-10-20 — — CN claimed
CN-115637057-A Synthesis method of double-crosslinking azo disperse dye 绍兴文理学院 2023-01-24 — — CN claimed
CN-112679366-A Purification method of N- (2-aminoethyl) -N-ethyl m-toluidine 上海俪源科技有限公司 2021-04-20 — — CN claimed
CN-112552187-A Purification method of N- (2-aminoethyl) -N-ethyl m-toluidine 上海俪源科技有限公司 2021-03-26 — — CN claimed
US-8557796-B2 Substituted 1-oxa-2,8-diaza-spiro [4,5] dec-2-ene derivatives and related treatment methods GRUENENTHAL GMBH (DE) 2013-10-15 — — US claimed
US-7968591-B2 1,3-disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their use in medicaments GRUENENTHAL GMBH (DE) 2011-06-28 — — US claimed
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 — — EP claimed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 — — EP claimed
US-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments GRUENENTHAL GMBH (DE) 2009-05-28 — — US claimed
EP-1401841-B1 SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN GRUENENTHAL GMBH (DE) 2005-08-24 — — EP claimed
EP-1126833-A4 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES INC (US) 2004-09-08 — — EP claimed
EP-1126833-A2 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2001-08-29 — — EP claimed
WO-2000025768-A1 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2000-05-11 — — WO claimed
CN-115637057-B Synthesis method of double-crosslinking azo disperse dye 绍兴文理学院 2023-10-20 — — CN disclosed
EP-3152210-B1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2023-07-05 — — EP disclosed
CN-115637057-A Synthesis method of double-crosslinking azo disperse dye 绍兴文理学院 2023-01-24 — — CN disclosed
US-4260679-A Method and reagent for the quantitative determination of hydrogen peroxide and precursors thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1981-04-07 — — US disclosed
EP-0007787-A1 Method and reagent for the quantitative determination of hydrogen peroxide KYOWA HAKKO KOGYO CO., LTD (JP) 1980-02-06 — — EP disclosed
US-4098783-A Dye substituted cyclic 1,3-sulfur-nitrogen compounds as dye image-forming materials in photography POLAROID CORPORATION (US) 1978-07-04 — — US disclosed
US-4038240-A PROCESS FOR DYEING POLYURETHANE RESINS BAYER AKTIENGESELLSCHAFT (DT) 1977-07-26 — — 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 (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-20090137573-A1 1,3-Disubstituted 4-methyl-1H-pyrrole-2-carboxamides and their Use in Medicaments OPRL1, TPH1, OPRK1 GFER 3535/4885ALDH1A1 2168/4885CYP3A4 2491/4885

“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.

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