SCHEMBL411353

SCHEMBL411353

Brc1ccc2[nH]c3c(c2c1)CNCC3

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.64
TAAR1 Q96RJ0 1/20 0.59
RAD52 P43351 1/20 0.58
KMT2A Q03164 1/20 0.58
SIRT2 Q8IXJ6 1/20 0.57
HSD17B10 Q99714 2/20 0.54
BAZ2B Q9UIF8 2/20 0.49
LMNA P02545 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
RECQL P46063 1/20 0.48
PMP22 Q01453 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
PARP1 P09874 1/20 0.46
HTR2A P28223 1/20 0.46

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
Hydrochloric Acid SCHEMBL18345594 0.98 TAAR1 (0.62) MAPTTAAR1RAD52KMT2ASIRT2
SCHEMBL1872944 0.87 MAPT (0.64) MAPTHSD17B10BAZ2BLMNACYP1A2
SCHEMBL18345852 0.87 TAAR1 (0.59) MAPTTAAR1RAD52KMT2ASIRT2
SCHEMBL12868071 0.85 MAPT (0.60) MAPTRAD52KMT2AHSD17B10BAZ2B
SCHEMBL30228634 0.81 TAAR1 (0.59) TAAR1RAD52KMT2ASIRT2HSD17B10
SCHEMBL2313213 0.81 TAAR1 (0.59) TAAR1RAD52KMT2ASIRT2HSD17B10
SCHEMBL2243566 0.81 PARP1 (0.67) TAAR1RAD52KMT2ASIRT2HSD17B10
SCHEMBL2980510 0.81 SIRT2 (0.72) MAPTTAAR1RAD52KMT2ASIRT2
Hydrochloric Acid SCHEMBL21630948 0.79 PARP1 (0.65) TAAR1RAD52KMT2ASIRT2HSD17B10
Hydrochloric Acid SCHEMBL8508190 0.79 TAAR1 (0.62) TAAR1RAD52KMT2ASIRT2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4682146-A1 COMPOSITION INCLUDING NOVEL PYRIDOINDOLE DERIVATIVE COMPOUND AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISEASES Neurotarge Co., Ltd. (KR) 2026-01-21 EP disclosed
WO-2024191255-A1 COMPOSITION INCLUDING NOVEL PYRIDOINDOLE DERIVATIVE COMPOUND AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISEASES 한국과학기술연구원 2024-09-19 WO disclosed
EP-3820867-B1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2023-09-13 EP disclosed
US-20210292324-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS ISTITUTO GIANNINA GASLINI (IT) 2021-09-23 US disclosed
EP-3313837-B1 CARBOLINE ANTIPARASITICS ZOETIS SERVICES LLC (US) 2020-09-09 EP disclosed
US-10570129-B2 Carboline antiparasitics ZOETIS SERVICES LLC (US) 2020-02-25 US disclosed
US-20200031822-A1 CARBOLINE ANTIPARASITICS ZOETIS SERVICES LLC (US) 2020-01-30 US disclosed
WO-2020012427-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2020-01-16 WO disclosed
US-10183011-B2 Anti-depression compounds BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-01-22 US disclosed
US-20180318255-A1 Pro-Neurogenic Compounds BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2018-11-08 US disclosed
EP-2170879-B1 1-CYANOCYCLOPROPYL-DERIVATIVES AS CATHEPSIN K INHIBITORS ASTRAZENECA AB (SE) 2013-01-16 EP disclosed
US-20120022096-A1 PRO-NEUROGENIC COMPOUNDS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-01-26 US disclosed
WO-2012006419-A2 PRO-NEUROGENIC COMPOUNDS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-01-12 WO disclosed
US-8008279-B2 Compound—827 ASTRAZENECA AB (SE) 2011-08-30 US disclosed
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20090012077-A1 Novel Compound - 827 ASTRAZENECA AB (SE) 2009-01-08 US disclosed
US-20060199829-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. 2006-09-07 US disclosed
EP-1414819-B1 THERAPEUTIC 1H-PYRIDO[4,3-b]INDOLES PHARMACIA & UPJOHN CO LLC (US) 2005-10-12 EP disclosed
US-6849640-B2 Therapeutic 1H-pyrido [4,3-b] indoles PHARMACIA & UPJOHN COMPANY (US) 2005-02-01 US disclosed
US-20030060464-A1 Therapeutic 1H-pyrido [ 4, 3-b ] indoles PHARMACIA & UPJOHN COMPANY 2003-03-27 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 (9 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-20120022096-A1 PRO-NEUROGENIC COMPOUNDS BDNF, GAP43, DCX MAPT 136/4885TAAR1 2341/4885RAD52 3297/4885
US-20180318255-A1 Pro-Neurogenic Compounds BDNF, GAP43, DCX MAPT 136/4885TAAR1 2341/4885RAD52 3297/4885
US-20060199829-A1 Inhibitors of histone deacetylase HDAC1, HDAC2, HDAC11 MAPT 2758/4885TAAR1 4360/4885RAD52 563/4885
US-10183011-B2 Anti-depression compounds BDNF, DCX, GAP43 MAPT 142/4885TAAR1 3126/4885RAD52 2718/4885
US-10570129-B2 Carboline antiparasitics ADRA1D, DRD1, CHRM1 MAPT 4298/4885TAAR1 837/4885RAD52 2411/4885
US-20210292324-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, ABCB11, ABCC5 MAPT 4258/4885TAAR1 3882/4885RAD52 4798/4885
US-20090012077-A1 Novel Compound - 827 CTSS, CTSF, CTSB MAPT 2312/4885TAAR1 4785/4885RAD52 2930/4885
US-20030060464-A1 Therapeutic 1H-pyrido [ 4, 3-b ] indoles HTR3B, HTR4, HTR3C MAPT 1262/4885TAAR1 74/4885RAD52 3598/4885
US-20200031822-A1 CARBOLINE ANTIPARASITICS DRD1, ADRA1D, DRD2 MAPT 4336/4885TAAR1 507/4885RAD52 2752/4885

“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.