SCHEMBL6135412

SCHEMBL6135412

N[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 17/20 0.55
NPC1 O15118 1/20 0.49
MTOR P42345 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL9185372 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL8078188 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL6604556 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL13875665 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL472020 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL14364969 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL6135633 1.00 TACR1 (0.55) TACR1NPC1MTORRAB9A
SCHEMBL7121023 0.90 TACR1 (0.49) TACR1NPC1MTORRAB9A
SCHEMBL9537788 0.87 TACR1 (0.46) TACR1
SCHEMBL9532928 0.87 TACR1 (0.46) TACR1

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
CN-112557541-B Detection method of maropiptan citrate and related substances thereof 河北科技大学 2022-07-12 CN disclosed
EP-1551833-A1 PROCESS FOR THE PREPARATION OF (S,S)-CIS-2-BENZHYDRYL-3-BENZYLAMINOQUINUCLIDINE Pfizer Products Inc. (US) 2005-07-13 EP disclosed
US-20050085641-A1 Process for the preparation of (S,S)-cis-2-benzhydryl-3-benzylaminoquinuclidine PFIZER INC. 2005-04-21 US disclosed
US-6861526-B2 Process for the preparation of (S,S)-cis-2-benzhydryl-3-benzylaminoquinuclidine PFIZER INC. (US) 2005-03-01 US disclosed
EP-0917869-B1 Use of water-in-oil emulsions as thickening agents in cosmetical and pharmaceutical compositions BASF AG (DE) 2005-01-26 EP disclosed
US-20040116704-A1 Process for the preparation of (S,S)-cis-2-benzhydryl-3-benzylaminoquinuclidine PFIZER INC. 2004-06-17 US disclosed
WO-2004035575-A1 PROCESS FOR THE PREPARATION OF (S,S)-CIS-2-BENZHYDRYL-3-BENZYLAMINOQUINUCLIDINE PFIZER PRODUCTS, INC. (US) 2004-04-29 WO disclosed
EP-1114823-A2 Substituted benzylamino nitrogen containing non-aromatic heterocycles PFIZER INC. (US) 2001-07-11 EP disclosed
EP-0917869-A2 Use of water-in-oil emulsions as thickening agents in cosmetical and pharmaceutical compositions BASF AKTIENGESELLSCHAFT (DE) 1999-05-26 EP disclosed
EP-0783535-B1 PROCESS FOR PREPARING AQUEOUS SOLUTIONS OF POLY(N-VINYL-EPSILON-CAPROLACTAM) AND THEIR USE BASF AG (DE) 1998-05-13 EP disclosed
EP-0655996-A1 SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES PFIZER INC. (US) 1995-06-07 EP disclosed
WO-1994004496-A9 SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES 1995-01-26 WO disclosed
WO-1994004496-A1 SUBSTITUTED BENZYLAMINO NITROGEN CONTAINING NON-AROMATIC HETEROCYCLES PFIZER INC. (US) 1994-03-03 WO disclosed
EP-0409931-B1 QUINUCLIDINE THERAPEUTIC AGENTS PFIZER (US) 1994-02-16 EP disclosed
US-5162339-A Substance P Antagonists, Gastrointestinal and Central Nervous System Disorders, Antiinflammatory Agents, Analgesics PFIZER INC. (US) 1992-11-10 US disclosed
EP-0409931-A1 QUINUCLIDINE THERAPEUTIC AGENTS. PFIZER (US) 1991-01-30 EP disclosed
WO-1990005729-A1 QUINUCLIDINE THERAPEUTIC AGENTS PFIZER INC. (US) 1990-05-31 WO 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-20050085641-A1 Process for the preparation of (S,S)-cis-2-benzhydryl-3-benzylaminoquinuclidine BCKDK, SRM, SKP1 TACR1 1140/4885NPC1 2728/4885MTOR 1813/4885

“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.