SCHEMBL2793079

SCHEMBL2793079

c1ccc2c(c1)CCN(CC1CCNCC1)C2

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.50
PRMT5 O14744 2/20 0.48
WDR77 Q9BQA1 2/20 0.48
TP53 P04637 1/20 0.47
ACHE P22303 1/20 0.47
THRB P10828 3/20 0.46
LMNA P02545 2/20 0.46
DRD1 P21728 1/20 0.46
DRD5 P21918 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.45

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 SCHEMBL10415650 0.98 DRD2 (0.49) DRD2PRMT5WDR77TP53ACHE
Hydrochloric Acid SCHEMBL1625872 0.98 DRD2 (0.49) DRD2PRMT5WDR77TP53ACHE
SCHEMBL5646802 0.89 GBA1 (0.47) PRMT5WDR77
SCHEMBL38653916 0.89 DRD2 (0.59) DRD2PRMT5WDR77TP53ACHE
Hydrochloric Acid SCHEMBL9633666 0.87 GBA1 (0.46)
SCHEMBL38653251 0.85 PRMT5 (0.54) DRD2PRMT5WDR77TP53
SCHEMBL5687764 0.85 ACHE (0.65) DRD2ACHE
SCHEMBL2437081 0.84 PRMT5 (0.56) DRD2PRMT5WDR77
SCHEMBL2616312 0.83 MAOA (0.55) DRD2TP53ACHETHRBLMNA
Hydrochloric Acid SCHEMBL14974971 0.83 PRMT5 (0.55) DRD2PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2025481-A None JP disclosed
JP-1100167-A None JP disclosed
EP-1781661-B1 VASOPRESSIN V1A ANTAGONISTS VANTIA LTD (GB) 2017-06-07 EP disclosed
EP-1831195-B1 5-HT7 RECEPTOR ANTAGONISTS ESTEVE LABOR DR (ES) 2012-12-19 EP disclosed
US-7928121-B2 2-[1-(5-Chloro-2,4-difluoro-benzenesulfonyl)-piperidin-4-ylmethyl]-1,2,3,4-tetrahydroisoquinolinehydrochloride; antidepressant, anxiolytic, hypotensive agent; psychosis, schizophrenia, migraine, cognition activity; pharmacokinetics LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2011-04-19 US disclosed
US-7928121-B2 2-[1-(5-Chloro-2,4-difluoro-benzenesulfonyl)-piperidin-4-ylmethyl]-1,2,3,4-tetrahydroisoquinolinehydrochloride; antidepressant, anxiolytic, hypotensive agent; psychosis, schizophrenia, migraine, cognition activity; pharmacokinetics LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2011-04-19 US disclosed
US-20100168093-A1 SUBSTITUTED 3-AMINO-4 -HYDROXY PYRROLIDINES COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIES DE DR. ESTEVE, S.A. (ES) 2010-07-01 US disclosed
US-20080214603-A1 5-Ht7 Receptor Antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2008-09-04 US disclosed
US-20080214603-A1 5-Ht7 Receptor Antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2008-09-04 US disclosed
US-7345057-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2008-03-18 US disclosed
US-4945096-A Treatment of a depressive state with 2-[(4-piperidyl)methyl]-1,2,3,4-tetrahydroisoquinoline derivates SYNTHELABO (FR) 1990-07-31 US disclosed
US-4940645-A Imaging material employing photosensitive microcapsules containing tertiary amines as coinitiators THE MEAD CORPORATION (US) 1990-07-10 US disclosed
US-4925850-A SLEEP, CARDIOVASCULAR, AND NERVOUS SYSTEM DISORDERS; DIETETICS, ANXIOLYTIC AGENTS SYNTHELABO (FR) 1990-05-15 US disclosed
US-4925850-A SLEEP, CARDIOVASCULAR, AND NERVOUS SYSTEM DISORDERS; DIETETICS, ANXIOLYTIC AGENTS SYNTHELABO (FR) 1990-05-15 US disclosed
JP-H0225481-A 2-((4-PIPERIDINYL)METHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVE, ITS PRODUCTION AND ITS APPLICATION IN IHERAPEUTICS SYNTHELABO SA 1990-01-26 JP disclosed
EP-0351255-A2 Derivatives of 2-[(4-piperidinyl)methyl]-1,2,3,4-tetrahydroisoquinoline, their preparation and their use in therapy SYNTHELABO (FR) 1990-01-17 EP disclosed
US-4885302-A 2-((4-Piperidyl)methyl)-1,2,3,4-tetrahydroisoquinoline derivatives, their preparation and their application in therapy SYNTHELABO, 58, RUE DE LA GLACIERE - 75013 PARIS 1989-12-05 US disclosed
US-4885302-A 2-((4-Piperidyl)methyl)-1,2,3,4-tetrahydroisoquinoline derivatives, their preparation and their application in therapy SYNTHELABO, 58, RUE DE LA GLACIERE - 75013 PARIS 1989-12-05 US disclosed
JP-H01100167-A 2-((4-PIPERIDYL)METHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVE SYNTHELABO SA 1989-04-18 JP disclosed
EP-0306375-A1 2-[(4-Piperidinyl)methyl]-1,2,3,4-tetrahydroisoquinoline derivatives, their preparation and their use in therapy SYNTHELABO (FR) 1989-03-08 EP 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 (2 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-20080214603-A1 5-Ht7 Receptor Antagonists HTR7, HTR1A, HTR5A DRD2 39/4885PRMT5 1967/4885WDR77 3403/4885
US-20100168093-A1 SUBSTITUTED 3-AMINO-4 -HYDROXY PYRROLIDINES COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS PAH, HMBS, P4HA1 DRD2 1033/4885PRMT5 109/4885WDR77 1039/4885

“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.