Benzylamine

Benzylamine

SCHEMBL5450068

NCc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.61
CES1 P23141 7/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
CYP2C19 P33261 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.50
HIF1A Q16665 1/20 0.50
CPA1 P15085 1/20 0.49
TAAR1 Q96RJ0 1/20 0.46
FAAH O00519 3/20 0.46
ALPI P09923 1/20 0.45
PKM P14618 1/20 0.45
PTGS1 P23219 1/20 0.45
XIAP P98170 1/20 0.45
SLC7A5 Q01650 1/20 0.45
KEAP1 Q14145 1/20 0.45
ITGB3 P05106 1/20 0.43
ITGB1 P05556 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
Trifluoroacetic Acid SCHEMBL7734068 0.88 TAAR1 (0.67) LOXL2CES1CYP1A2CYP2D6CYP2C9
Benzylamine SCHEMBL2841170 0.84 LOXL2 (0.78) LOXL2CES1CYP1A2CYP2D6CYP2C9
Benzylamine SCHEMBL2841167 0.84 LOXL2 (0.78) LOXL2CES1CYP1A2CYP2D6CYP2C9
Phenethylamine SCHEMBL20239925 0.83 TAAR1 (0.64) LOXL2CES1SMN1; SMN2HIF1ACPA1
Trifluoroacetic Acid SCHEMBL30182273 0.83 LOXL2 (0.60) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Trifluoroacetic Acid SCHEMBL28713743 0.83 LOXL2 (0.64) LOXL2SMN1; SMN2TAAR1ITGB3ITGB1
Benzylamine SCHEMBL27825396 0.83 LOXL2 (0.61) LOXL2CES1CYP1A2CYP2D6CYP2C9
Trifluoroacetic Acid SCHEMBL7850280 0.82 ALDH1A1 (0.48) LOXL2CYP1A2CYP2C19SMN1; SMN2TAAR1
Aminomethylbenzoic Acid SCHEMBL7422142 0.82 ALDH1A1 (0.50) LOXL2CYP1A2TSHRITGB3ITGB1
Trifluoroacetic Acid SCHEMBL18587850 0.82 ITGB3 (0.44) LOXL2SMN1; SMN2ITGB3ITGB1ITGAV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111333641-B Enhanced fluorescent probe for tetrazine bio-orthogonal labeling and synthesis thereof 中国科学院大连化学物理研究所 2022-05-31 CN claimed
EP-2864308-B1 (3aR,6aS)-2-Hydroxy-3,3a,6,6a-tetrahydro-2H-cyclopenta[b]furan-5-carbaldehyde intermediates for the preparation of prostaglandins or prostaglandin analogues UNIV BRISTOL (GB) 2016-10-19 EP claimed
US-9242954-B2 Lactol and acetal intermediates for making prostaglandins UNIVERSITY OF BRISTOL (GB) 2016-01-26 US claimed
US-20150158837-A1 Compound And Method TOPOKINE THERAPEUTICS, INC. 2015-06-11 US claimed
EP-2864308-A1 COMPOUND AND METHOD University Of Bristol (GB) 2015-04-29 EP claimed
WO-2013186550-A1 COMPOUND AND METHOD UNIVERSITY OF BRISTOL (GB) 2013-12-19 WO claimed
CN-1190395-A Substituted (sulfonic, sulfinic, sulfonamido or sulfonamido) N- [ aminoiminomethyl) phenylalkyl ] -azaheterocyclic amide compounds RHONE POULENC RORER PHARMA (US) 1998-08-12 CN claimed
EP-4568951-A1 HETEROCYCLIC AMIDE AND UREA COMPOUNDS AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2025-06-18 EP disclosed
CN-119654314-A Heterocyclic amide and urea compounds as JAK2 inhibitors 艾捷斯治疗公司 2025-03-18 CN disclosed
US-20240116892-A1 HETEROCYCLIC AMIDE AND UREA COMPOUNDS AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2024-04-11 US disclosed
WO-2024035627-A1 HETEROCYCLIC AMIDE AND UREA COMPOUNDS AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2024-02-15 WO disclosed
EP-4161578-A1 THERAPEUTIC CONJUGATES Starpharma Pty Limited (AU) 2023-04-12 EP disclosed
US-10618884-B2 Deuterated diaminopyrimidine compounds and pharmaceutical compositions comprising such compounds SUZHOU ZELGEN BIOPHARMACEUTICALS CO., LTD. (CN) 2020-04-14 US disclosed
EP-1222172-A1 SYNTHESIS OF 1,3,5-TRISUBSTITUTED PYRAZOLES AND INTERMEDIATES THEREFORE Bristol-Myers Squibb Pharma Company (US) 2002-07-17 EP disclosed
US-20020055641-A1 Synthesis of 1,3,5-trisubstituted pyrazoles BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-09 US disclosed
WO-2002022845-A1 PROCESS FOR PREPARING N-SUBSTITUTED 4-HYDROXYPIPERIDINES BY ENZYMATIC HYDROXYLATION Eidgenössische Technische Hochschule Zürich (CH) 2002-03-21 WO disclosed
EP-1188837-A1 Process for preparing N-substituted 4-hydroxypiperidines by enzymatic hydroxylation Eidgenössische Technische Hochschule Zürich (CH) 2002-03-20 EP disclosed
US-6329527-B1 ACYLATING SUBSTITUTEDARYL HYDRAZINE, FORMING DIPOLAR COMPOUND, CONTACTING DIPOLAROPHILE AND SUBJECTING TO OXIDATION, REMOVING PROTECTING GROUP BRISTOL-MYERS SQUIBB PHARMA COMPANY 2001-12-11 US disclosed
WO-2001029006-A1 SYNTHESIS OF 1,3,5-TRISUBSTITUTED PYRAZOLES AND INTERMEDIATES THEREFORE BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-04-26 WO disclosed
CN-1190395-A Substituted (sulfonic, sulfinic, sulfonamido or sulfonamido) N- [ aminoiminomethyl) phenylalkyl ] -azaheterocyclic amide compounds RHONE POULENC RORER PHARMA (US) 1998-08-12 CN 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 (4 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-20240116892-A1 HETEROCYCLIC AMIDE AND UREA COMPOUNDS AS JAK2 INHIBITORS JAK2, JAK1, JAK3 LOXL2 3516/4885CES1 3621/4885CYP1A2 4251/4885
US-20020055641-A1 Synthesis of 1,3,5-trisubstituted pyrazoles TFPI, SERPINC1, F11 LOXL2 2647/4885CES1 161/4885CYP1A2 114/4885
US-10618884-B2 Deuterated diaminopyrimidine compounds and pharmaceutical compositions comprising such compounds DCK, DPYD, BRAF LOXL2 4310/4885CES1 4179/4885CYP1A2 3036/4885
US-20150158837-A1 Compound And Method CYP4A11, NR1H2, NR1H3 LOXL2 1954/4885CES1 544/4885CYP1A2 78/4885

“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.