SCHEMBL9729120

SCHEMBL9729120

NCC(O)c1ccc(N)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.67
▸ NFKB1 P19838 3/20 0.67
▸ TSHR P16473 2/20 0.67
▸ HIF1A Q16665 2/20 0.67
▸ HTR3A P46098 1/20 0.67
▸ TDP1 Q9NUW8 4/20 0.64
▸ KDM4E B2RXH2 4/20 0.64
▸ APEX1 P27695 3/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ BLM P54132 5/20 0.54
▸ MAPT P10636 4/20 0.54
▸ RECQL P46063 3/20 0.54
▸ HPGD P15428 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ ADRB2 P07550 2/20 0.54
▸ ADRB1 P08588 2/20 0.54
▸ ADRA2A P08913 2/20 0.54
▸ ADRA2B P18089 2/20 0.54
▸ ADRA2C P18825 2/20 0.54

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
SCHEMBL4074768 0.89 TAAR1 (0.80) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL7490714 0.83 TAAR1 (0.64) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL10714160 0.80 CYP19A1 (0.46) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL13880000 0.80 TAAR1 (0.67) TAAR1NFKB1TSHRHIF1AHTR3A
Octopamine SCHEMBL3489184 0.80 TAAR1 (1.00) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL18434948 0.80 CYP19A1 (0.46) TAAR1NFKB1TSHRHIF1AHTR3A
Octopamine SCHEMBL1650462 0.80 TAAR1 (1.00) TAAR1NFKB1TSHRHIF1AHTR3A
Octopamine SCHEMBL22605 0.80 TAAR1 (1.00) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL7210158 0.78 TAAR1 (0.64) TAAR1NFKB1TSHRHIF1AHTR3A
SCHEMBL531326 0.78 TAAR1 (0.64) TAAR1NFKB1TSHRHIF1AHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103709116-A Preparation method for 4-(4-alkoxycarbonylamino)phenyl-3-morpholine UNIV SICHUAN 2014-04-09 — — CN claimed
EP-0226072-B1 OXIDATION DYE CONTAINING 4-AMINO-2-AMINOMETHYL PHENOL Wella Aktiengesellschaft (DE) 1991-04-10 — — EP claimed
EP-0146738-B1 ANTIMICROBIAL ANIMAL FEED ADDITIVE COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1990-12-19 — — EP claimed
EP-0252351-B1 5-ALKOXY-2,4-DIAMINO-ALKYLBENZENES AND HAIR DYES CONTAINING SAME Wella Aktiengesellschaft (DE) 1990-09-12 — — EP claimed
US-4797130-A DYE DEVELOPERS GOOD FOR RED COLORING WELLA AKTIENGESELLSCHAFT (DE) 1989-01-10 — — US claimed
EP-0252351-A1 5-Alkoxy-2,4-diamino-alkylbenzenes and hair dyes containing same Wella Aktiengesellschaft (DE) 1988-01-13 — — EP claimed
US-4713080-A OXIDATIVE COLORING WELLA AKTIENGESELLSCHAFT (DE) 1987-12-15 — — US claimed
EP-0226072-A1 Oxidation dye containing 4-amino-2-aminomethyl phenol Wella Aktiengesellschaft (DE) 1987-06-24 — — EP claimed
WO-1987003475-A2 OXIDIZING HAIR DYER BASED ON 4-AMINO-2-AMINOMETHYLPHENOLS WELLA AKTIENGESELLSCHAFT (DE) 1987-06-18 — — WO claimed
EP-0182187-A1 Oxidative dyestuff compositions for dyeing the hair, consisting of 4-amino-2-hydroxyalkyl phenols Wella Aktiengesellschaft (DE) 1986-05-28 — — EP claimed
WO-1986002829-A1 OXIDATION-TYPE HAIR-DYEING MEANS BASED ON 4-AMINO-2-HYDROXYALKYL-PHENOLS WELLA AKTIENGESELLSCHAFT (DE) 1986-05-22 — — WO claimed
EP-0166025-A2 Non-antibiotic animal feed additive compositions AMERICAN CYANAMID COMPANY (US) 1986-01-02 — — EP claimed
EP-0146738-A2 Antimicrobial animal feed additive compositions AMERICAN CYANAMID COMPANY (US) 1985-07-03 — — EP claimed
US-20240216525-A1 ENZYME-TRIGGERED SELF-REACTING LINKER HAVING IMPROVED PHYSICOCHEMICAL AND PHARMACOLOGICAL PROPERTIES MABLINK BIOSCIENCE (FR) 2024-07-04 — — US disclosed
EP-4313157-A1 ENZYME-TRIGGERED SELF-REACTING LINKER HAVING IMPROVED PHYSICOCHEMICAL AND PHARMACOLOGICAL PROPERTIES Mablink Bioscience (FR) 2024-02-07 — — EP disclosed
CN-117157102-A Enzyme-triggered self-reacting linkers with improved physicochemical and pharmacological properties 马布林克生物科学公司 2023-12-01 — — CN disclosed
EP-0146738-A2 Antimicrobial animal feed additive compositions AMERICAN CYANAMID COMPANY (US) 1985-07-03 — — EP disclosed
EP-0146738-A2 Antimicrobial animal feed additive compositions AMERICAN CYANAMID COMPANY (US) 1985-07-03 — — EP disclosed
US-4119710-A ANALGESICS, UTEROSPASMOLYTICS, ANTISPASTICS, BLOCKING AGENTS BOEHRINGER INGELHEIM GMBH (DE) 1978-10-10 — — US disclosed
US-4119710-A ANALGESICS, UTEROSPASMOLYTICS, ANTISPASTICS, BLOCKING AGENTS BOEHRINGER INGELHEIM GMBH (DE) 1978-10-10 — — 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-20240216525-A1 ENZYME-TRIGGERED SELF-REACTING LINKER HAVING IMPROVED PHYSICOCHEMICAL AND PHARMACOLOGICAL PROPERTIES DDC, BCHE, ENGASE TAAR1 2170/4885NFKB1 3924/4885TSHR 2759/4885

“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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