SCHEMBL836046

SCHEMBL836046

CC(C)[C@H](N)C(=O)Nc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.59
ALDH1A1 P00352 4/20 0.58
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
RXFP1 Q9HBX9 1/20 0.58
POLB P06746 1/20 0.53
GAA P10253 3/20 0.53
LMNA P02545 2/20 0.53
ATM Q13315 2/20 0.53
TP53 P04637 2/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
HPGD P15428 3/20 0.50
HTT P42858 2/20 0.50
RAB9A P51151 2/20 0.50
HSP90AA1 P07900 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GPR55 Q9Y2T6 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL835887 1.00 TAAR1 (0.59) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL24832296 1.00 TAAR1 (0.59) TAAR1ALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL31491245 0.98 TAAR1 (0.57) TAAR1ALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL31491246 0.98 TAAR1 (0.57) TAAR1ALDH1A1MAPTMEN1KMT2A
Acetic Acid SCHEMBL8935152 0.96 TAAR1 (0.56) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4651929 0.90 TAAR1 (0.76) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL1750312 0.90 TAAR1 (0.76) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL14546953 0.87 TAAR1 (0.57) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL400176 0.85 TAAR1 (0.53) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL11760683 0.85 SMN1; SMN2 (0.67) TAAR1ALDH1A1SMN1; SMN2HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3838893-B1 LINKER, ANTIBODY-DRUG CONJUGATE INCLUDING SAME, AND USE THEREOF ACAD OF MILITARY MEDICAL SCIENCES (CN) 2023-04-19 EP disclosed
US-20210205464-A1 Linker Containing Arylnitro, Antibody-Drug Conjugate Containing Linker and Use of Linker ZHEJIANG YANGSHENGTANG INSTITUTE OF NATURAL MEDICATION CO., LTD. (CN) 2021-07-08 US disclosed
EP-3845251-A1 LINKER CONTAINING ARYLNITRO, ANTIBODY-DRUG CONJUGATE CONTAINING LINKER AND USE OF LINKER Academy of Military Medical Sciences (CN) 2021-07-07 EP disclosed
EP-3838893-A1 LINKER, ANTIBODY-DRUG CONJUGATE INCLUDING SAME, AND USE THEREOF Academy of Military Medical Sciences (CN) 2021-06-23 EP disclosed
WO-2020043129-A1 LINKER CONTAINING ARYLNITRO, ANTIBODY-DRUG CONJUGATE CONTAINING LINKER AND USE OF LINKER 中国人民解放军军事科学院军事医学研究院 2020-03-05 WO disclosed
WO-2020035027-A1 LINKER, ANTIBODY-DRUG CONJUGATE INCLUDING SAME, AND USE THEREOF 中国人民解放军军事科学院军事医学研究院 2020-02-20 WO disclosed
EP-1280928-B1 RESISTANCE TO ACETOHYDROXYACID SYNTHASE-INHIBITING HERBICIDES UNIV LOUISIANA STATE (US) 2016-11-30 EP disclosed
US-20150344902-A1 Resistance to Acetohydroxyacid Synthase-Inhibiting Herbicides BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2015-12-03 US disclosed
US-20150216126-A1 Herbicide Resistant Rice BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2015-08-06 US disclosed
US-9090904-B2 Resistance to acetohydroxyacid synthase-inhibiting herbicides BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2015-07-28 US disclosed
EP-1126756-B1 HERBICIDE RESISTANT RICE UNIV LOUISIANA STATE (US) 2004-06-09 EP disclosed
US-20030217381-A1 Resistance to acetohydroxycid synthase-inhibiting herbicides BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2003-11-20 US disclosed
EP-1280928-A2 RESISTANCE TO ACETOHYDROXYACID SYNTHASE-INHIBITING HERBICIDES Board of Supervisors of Louisiana State University and Agricultural and Mechanical College (US) 2003-02-05 EP disclosed
US-20020019313-A1 Plants with sources of resistance to herbicides that normally inhibit a plant's acetohydroxyacid synthase enzyme CROUGHAN TIMOTHY P (US) 2002-02-14 US disclosed
WO-2001085970-A2 RESISTANCE TO ACETOHYDROXYACID SYNTHASE-INHIBITING HERBICIDES BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2001-11-15 WO disclosed
EP-1126756-A1 HERBICIDE RESISTANT RICE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2001-08-29 EP disclosed
US-6117870-A USEFUL AS THERAPEUTIC DRUG OR PREVENTIVE DRUG OF ARTHRITIS AND RHEUMATISM DUE TO INCREASE OF BONE RESORPTION IN ADDITION TO BONE DISEASES SUCH AS OSTEOPOROSIS, HYPERCALCEMIA, AND PAGET'S DISEASE FUJIREBIO KABUSHIKI KAISHA (JP) 2000-09-12 US disclosed
EP-1008592-A2 Cyclic amide derivatives which inhibit cathepsin K Fujirebio Kabushiki Kaisha (JP) 2000-06-14 EP disclosed
WO-2000027182-A1 HERBICIDE RESISTANT RICE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2000-05-18 WO disclosed
US-5633437-A ISOLATED NUCLEIC ACID SEQUENCE SANDOZ LTD. (CH) 1997-05-27 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-20210205464-A1 Linker Containing Arylnitro, Antibody-Drug Conjugate Containing Linker and Use of Linker BCR, FCGRT, ERBB2 TAAR1 776/4885ALDH1A1 962/4885MAPT 77/4885

“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.