SCHEMBL4043115

SCHEMBL4043115

c1ccc(NC2CCc3ccccc3C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 7/20 0.57
MTNR1A P48039 4/20 0.53
MTNR1B P49286 4/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
PLAU P00749 1/20 0.47
GBA1 P04062 2/20 0.44

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 SCHEMBL4053518 0.98 GRIN2B (0.56) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL10399460 0.86 MTNR1A (0.51) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL2980045 0.86 GRIN2B (0.47) GRIN2BCA1CA2SIGMAR1GBA1
SCHEMBL28583286 0.82 CA1 (0.48) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL24427605 0.80 GRM5 (0.46) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL30479468 0.80 GRIN2B (0.54) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL29033596 0.80 GRIN2B (0.54) GRIN2BMTNR1AMTNR1BCA1CA2
SCHEMBL10399768 0.80 TAOK1 (0.55) GRIN2BSIGMAR1
SCHEMBL9449692 0.79 GRIN2B (0.50) GRIN2BMAOAMAOBGBA1
SCHEMBL11851549 0.78 CA1 (0.57) GRIN2BMTNR1AMTNR1BCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080033052-A1 Dermal anesthetic compounds WRIGHT GEORGE E 2008-02-07 US claimed
WO-2008011161-A2 DERMAL ANESTHETIC COMPOUNDS BRIDGE PHARMA, INC. (US) 2008-01-24 WO claimed
CN-102351712-B Preparation method of N-phenyl-tetrahydro-2-naphthylamine JUNKAI TIANJIN CHEMICAL CO LTD 2013-11-27 CN disclosed
CN-102351712-B Preparation method of N-phenyl-tetrahydro-2-naphthylamine JUNKAI TIANJIN CHEMICAL CO LTD 2013-11-27 CN disclosed
CN-102351712-A New preparation method of N-phenyl-tetrahydro-2-naphthylamine JUNKAI TIANJIN CHEMICAL CO LTD 2012-02-15 CN disclosed
CN-102351712-A New preparation method of N-phenyl-tetrahydro-2-naphthylamine JUNKAI TIANJIN CHEMICAL CO LTD 2012-02-15 CN disclosed
US-7592458-B2 Dermal anesthetic compounds and pharmaceutical compositions for inducing local anesthesia and mitigating neuropathic pain WRIGHT GEORGE E 2009-09-22 US disclosed
US-7592458-B2 Dermal anesthetic compounds and pharmaceutical compositions for inducing local anesthesia and mitigating neuropathic pain WRIGHT GEORGE E 2009-09-22 US disclosed
US-7592458-B2 Dermal anesthetic compounds and pharmaceutical compositions for inducing local anesthesia and mitigating neuropathic pain WRIGHT GEORGE E 2009-09-22 US disclosed
US-20080033052-A1 Dermal anesthetic compounds WRIGHT GEORGE E 2008-02-07 US disclosed
US-20080033052-A1 Dermal anesthetic compounds WRIGHT GEORGE E 2008-02-07 US disclosed
US-20080033052-A1 Dermal anesthetic compounds WRIGHT GEORGE E 2008-02-07 US disclosed
WO-2008011161-A2 DERMAL ANESTHETIC COMPOUNDS BRIDGE PHARMA, INC. (US) 2008-01-24 WO disclosed
WO-2008011161-A2 DERMAL ANESTHETIC COMPOUNDS BRIDGE PHARMA, INC. (US) 2008-01-24 WO disclosed
US-3984464-A ANTIARRHYTHMIA AGENTS A. CHRISTIAENS SOCIETE ANONYME (BE) 1976-10-05 US disclosed
US-3970650-A DRUG INTERMEDIATE A. CHRISTIAENS SOCIETE ANONYME (BE) 1976-07-20 US disclosed
US-3943172-A ANTIARRHYTHMIA A. CHRISTIAENS, SOCIETE ANONYME (BE) 1976-03-09 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-20080033052-A1 Dermal anesthetic compounds TRPA1, FABP4, TRPV1 GRIN2B 2871/4885MTNR1A 1309/4885MTNR1B 1337/4885

“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.