SCHEMBL4890920

SCHEMBL4890920

C[C@H]1CCCN1C[C@H]1C[C@@H]1c1ccc(N)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
KDM1A O60341 1/20 0.40
HRH3 Q9Y5N1 17/20 0.38
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL4892097 1.00 ALDH1A1 (0.51) ALDH1A1KDM1AHRH3HTR2AHTR2C
SCHEMBL3944651 1.00 ALDH1A1 (0.51) ALDH1A1KDM1AHRH3HTR2AHTR2C
SCHEMBL3944648 1.00 ALDH1A1 (0.51) ALDH1A1KDM1AHRH3HTR2AHTR2C
SCHEMBL4889853 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL776338 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL4889856 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL4886693 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL776339 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL4886650 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B
SCHEMBL4896173 0.86 HTR2C (0.47) KDM1AHRH3HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9108948-B2 Cyclopropyl amine derivatives ABBVIE INC. (US) 2015-08-18 US disclosed
EP-2049472-B1 CYCLOPROPYL AMINE DERIVATIVES AS HISTAMIN H3 RECEPTOR MODULATORS ABBVIE BAHAMAS LTD (BS) 2015-01-21 EP disclosed
US-8829041-B2 Cyclopropyl amine derivatives ABBVIE INC. (US) 2014-09-09 US disclosed
US-20080242653-A1 Cyclopropyl amine derivatives ABBVIE INC. 2008-10-02 US disclosed
US-20080021081-A1 e.g. 4'-2-{[(2S)-2-methylpyrrolidin-1-yl]methyl}cyclopropyl)-1,1'-biphenyl-4-carbonitrile; histamine-3 receptor ligand; neuroleptic agent, neurodegenerative diseases, cognition activator; attention-deficit hyperactivity disorder, schizophrenia, Alzheimer's disease, epilepsy, seizures, allergic rhinitis ABBVIE INC. 2008-01-24 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 (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-20080021081-A1 e.g. 4'-2-{[(2S)-2-methylpyrrolidin-1-yl]methyl}cyclopropyl)-1,1'-biphenyl-4-carbonitrile; histamine-3 receptor ligand; neuroleptic agent, neurodegenerative diseases, cognition activator; attention-deficit hyperactivity disorder, schizophrenia, Alzheimer's disease, epilepsy, seizures, allergic rhinitis HRH4, HRH3, HNMT ALDH1A1 852/4885KDM1A 669/4885HRH3 2/4885
US-20080242653-A1 Cyclopropyl amine derivatives HRH3, HRH4, HRH2 ALDH1A1 1397/4885KDM1A 1513/4885HRH3 1/4885

“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.