SCHEMBL6686729

SCHEMBL6686729

O=C(O)Cc1c(-c2ccccc2)nc2ccccn12

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.58
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SLC2A1 P11166 1/20 0.52
GAA P10253 1/20 0.52
STAT3 P40763 1/20 0.52

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
SCHEMBL8208 0.90 KDM4E (0.64) SMN1; SMN2NPC1RAB9AKDM4ESLC2A1
SCHEMBL13341887 0.88 SMN1; SMN2 (0.56) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL7096969 0.88 NTRK1 (0.56) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL13341895 0.88 NPC1 (0.56) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14005644 0.88 MAPK1 (0.50) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL22780401 0.85 NTRK1 (0.57) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL13341897 0.84 GABRB2 (0.62) CYP1A2CYP2C9CYP2C19SMN1; SMN2NPC1
SCHEMBL13341900 0.84 ALDH1A1 (0.61) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL28392451 0.84 HDAC1 (0.47) SMN1; SMN2NPC1RAB9AALDH1A1KDM4E
SCHEMBL3613601 0.82 SLC2A2 (0.69) NTRK1CYP1A2CYP2C9CYP2C19SMN1; SMN2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230051850-A1 COMPOSITIONS AND METHODS FOR REDUCING TACTILE DYSFUNCTION, ANXIETY, AND SOCIAL IMPAIRMENT PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-02-16 US disclosed
CN-110981868-B Imidazopyridine compound, pharmaceutical composition containing compound, preparation method and application thereof SUN YAT-SEN UNIVERSITY (CN) 2021-08-31 CN disclosed
US-20210206771-A1 COMPOSITIONS AND METHODS FOR REDUCING TACTILE DYSFUNCTION, ANXIETY, AND SOCIAL IMPAIRMENT PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-07-08 US disclosed
CN-110981868-A Imidazopyridine compound, pharmaceutical composition containing compound, preparation method and application thereof 中山大学 2020-04-10 CN disclosed
US-8980887-B2 2-aryl imidazo[1,2-a]pyridine-3-acetamide derivatives, preparation methods and uses thereof INSTITUTE OF PHARMACOLOGY (CN) 2015-03-17 US disclosed
US-20130203754-A1 2-Aryl Imidazo[1,2-a]Pyridine-3-Acetamide Derivatives, Preparation Methods and Uses Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2013-08-08 US disclosed
US-7723324-B2 Imidazo[1,2-A]pyridine anxiolytics SEPRACOR, INC. (US) 2010-05-25 US disclosed
US-7566725-B2 Imidazo[1,2-A] pyridine anxiolytics SEPRACOR INC. (US) 2009-07-28 US disclosed
US-20080096867-A1 Imidazo[1,2-A] Pyridine Anxiolytics SEPRACOR INC. (US) 2008-04-24 US disclosed
US-20070043074-A1 IMIDAZO[1,2-A] PYRIDINE ANXIOLYTICS SEPRACOR INC. (US) 2007-02-22 US disclosed
EP-1071684-B1 IMIDAZO 1,2-a]PYRIDINES AS PERIPHERAL BENZODIAZEPINE RECEPTOR BINDING AGENTS AUSTRALIAN NUCLEAR SCIENCE TEC (AU) 2004-03-17 EP disclosed
US-6514969-B2 Alzheimer's diseas, Parkinson disease, Huntington disease BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-02-04 US disclosed
US-6379649-B1 USEFUL FOR DIAGNOSIS AND TREATMENT, INCLUDING RADIOTHERAPY, OF DISORDERS THAT ARE CHARACTERIZED BY AN ABNORMAL DENSITY OF PERIPHERAL BENZODIAZEPINE RECEPTORS; NERVE SYSTEM DISPORDERS AUSTRALIAN NUCLEAR SCIENCE & TECHNOLOGY ORGANISATION (AU) 2002-04-30 US disclosed
US-20020042420-A1 Beta-amyloid inhibitors, processes for preparing them, and their use in pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-04-11 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 (6 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-20230051850-A1 COMPOSITIONS AND METHODS FOR REDUCING TACTILE DYSFUNCTION, ANXIETY, AND SOCIAL IMPAIRMENT PMP22, GABBR1, MECP2 NTRK1 11/4885CYP1A2 4218/4885CYP2C9 3998/4885
US-20070043074-A1 IMIDAZO[1,2-A] PYRIDINE ANXIOLYTICS CNR1, CNR2, GABRA5 NTRK1 2237/4885CYP1A2 55/4885CYP2C9 262/4885
US-20020042420-A1 Beta-amyloid inhibitors, processes for preparing them, and their use in pharmaceutical compositions HTT, APP, BACE1 NTRK1 3316/4885CYP1A2 1164/4885CYP2C9 1935/4885
US-20210206771-A1 COMPOSITIONS AND METHODS FOR REDUCING TACTILE DYSFUNCTION, ANXIETY, AND SOCIAL IMPAIRMENT PMP22, GABBR1, MECP2 NTRK1 11/4885CYP1A2 4218/4885CYP2C9 3998/4885
US-20130203754-A1 2-Aryl Imidazo[1,2-a]Pyridine-3-Acetamide Derivatives, Preparation Methods and Uses Thereof TSPO, SLC6A1, TBXA2R NTRK1 504/4885CYP1A2 575/4885CYP2C9 1464/4885
US-20080096867-A1 Imidazo[1,2-A] Pyridine Anxiolytics MTNR1B, ADORA2B, ADRA2B NTRK1 2853/4885CYP1A2 59/4885CYP2C9 313/4885

“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.