SCHEMBL3475010

SCHEMBL3475010

c1ccc2c(c1)CCN1CCCCC21

nearest known ligand 0.90

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.90
TAAR1 Q96RJ0 1/20 0.57
TSHR P16473 1/20 0.51
OPRM1 P35372 1/20 0.50
OPRK1 P41145 1/20 0.50
OPRL1 P41146 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
SCHEMBL14239889 1.00 CHRNA7 (0.90) CHRNA7TAAR1TSHROPRM1OPRK1
Hydrochloric Acid SCHEMBL7516224 0.98 CHRNA7 (0.87) CHRNA7TAAR1TSHROPRM1OPRK1
SCHEMBL2811534 0.95 CHRNA7 (1.00) CHRNA7TAAR1OPRM1OPRK1OPRL1
Hydrochloric Acid SCHEMBL7509300 0.93 CHRNA7 (0.96) CHRNA7TAAR1OPRM1OPRK1OPRL1
Iodide SCHEMBL7016592 0.93 CHRNA7 (0.96) CHRNA7TAAR1OPRM1OPRK1OPRL1
SCHEMBL5899579 0.91 CHRNA7 (0.80) CHRNA7TAAR1TSHROPRM1OPRK1
SCHEMBL20137193 0.91 CHRNA7 (0.80) CHRNA7TAAR1TSHROPRM1OPRK1
SCHEMBL9737757 0.89 CHRNA7 (0.77) CHRNA7TAAR1TSHROPRM1OPRK1
SCHEMBL5264779 0.89 CHRNA7 (0.77) CHRNA7TAAR1TSHROPRM1OPRK1
SCHEMBL10753534 0.89 CHRNA7 (0.82) CHRNA7TAAR1OPRM1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0047105-A1 Benzoquinolizines, processes for their preparation and pharmaceutical compositions JOHN WYETH & BROTHER LIMITED (GB) 1982-03-10 EP claimed
US-20260083724-A1 COMPOUNDS TARGETING PAX3::FOXO1 FUSION PROTEIN GEORGETOWN UNIVERSITY (US) 2026-03-26 US disclosed
US-20200352917-A1 MEDICATED SPRAY FOR TREATMENT OF SUBSTANCE ABUSE, OVERDOSE, ADDICTION AND IMPULSE CONTROL DISORDERS GOOBERMAN LANCE L (US) 2020-11-12 US disclosed
US-20180273533-A1 [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2018-09-27 US disclosed
US-9988382-B2 [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido-[2,1-A]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2018-06-05 US disclosed
US-20170349586-A1 [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2017-12-07 US disclosed
US-8562949-B2 Radiolabeled dihydrotetrabenazine derivatives and their use as imaging agents THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-10-22 US disclosed
US-20100087475-A1 PHARMACEUTICAL COMPOUNDS Biovali Laboratories International (Barbados) S.R.L. (BB) 2010-04-08 US disclosed
US-20100087475-A1 PHARMACEUTICAL COMPOUNDS Biovali Laboratories International (Barbados) S.R.L. (BB) 2010-04-08 US disclosed
US-20080050312-A1 Radiolabeled dihydrotetrabenazine derivatives and their use as imaging agents THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2008-02-28 US disclosed
US-20070098781-A1 Modified release compositions for DPP-IV inhibitors HOFFMANN-LA ROCHE INC. 2007-05-03 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-20180273533-A1 [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO SLC18A2, SLC6A2, SLC18A1 CHRNA7 584/4885TAAR1 476/4885TSHR 1602/4885
US-20070098781-A1 Modified release compositions for DPP-IV inhibitors DPP4, DPP3, DPP7 CHRNA7 3351/4885TAAR1 3496/4885TSHR 2397/4885
US-20170349586-A1 [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO SLC18A2, SLC6A2, SLC18A1 CHRNA7 584/4885TAAR1 476/4885TSHR 1602/4885
US-20260083724-A1 COMPOUNDS TARGETING PAX3::FOXO1 FUSION PROTEIN PAX3, FOXO1, PAXBP1 CHRNA7 2245/4885TAAR1 4749/4885TSHR 2791/4885
US-20080050312-A1 Radiolabeled dihydrotetrabenazine derivatives and their use as imaging agents SLC18A2, SLC18A3, SLC6A2 CHRNA7 301/4885TAAR1 133/4885TSHR 1184/4885
US-20100087475-A1 PHARMACEUTICAL COMPOUNDS UGT2B7, CYP3A7, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 CHRNA7 311/4885TAAR1 3574/4885TSHR 3675/4885

“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.