SCHEMBL6084045

SCHEMBL6084045

Cc1ccc2ccc(-c3ccc(N(C)C)cc3)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 9/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
TERT O14746 1/20 0.47
CYP1A2 P05177 1/20 0.47
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
PARP1 P09874 1/20 0.43
ADK P55263 1/20 0.42
SYK P43405 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL12402694 0.90 MAOA (0.56) APPMAOAMAOBTERTCYP1A2
SCHEMBL13989416 0.86 CYP1A2 (0.57) CYP1A2ALDH1A1KDM4EESR1ESR2
SCHEMBL18573206 0.79 ESR1 (0.61) CYP1A2ALDH1A1ESR1ESR2
SCHEMBL62397 0.79 RAB9A (0.61) APPMAOAMAOBCYP1A2ALDH1A1
SCHEMBL398766 0.79 KDM4E (0.55) CYP1A2ALDH1A1KDM4EESR1TDP1
SCHEMBL15224383 0.79 APP (0.55) APPMAOAMAOBTERTCYP1A2
SCHEMBL28051566 0.78 CYP1A2 (0.67) CYP1A2ALDH1A1KDM4EGAATSHR
SCHEMBL10147842 0.77 CYP1A2 (0.59) CYP1A2ALDH1A1KDM4EESR1ESR2
SCHEMBL13989404 0.77 CYP1A2 (0.55) CYP1A2ALDH1A1KDM4EESR1
SCHEMBL20008616 0.77 TERT (0.80) APPTERTCYP1A2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2640703-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE Healthcare UK Limited (GB) 2013-09-25 EP claimed
US-20130236395-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE HEALTHCARE LIMITED (GB) 2013-09-12 US claimed
WO-2012067863-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE HEALTHCARE LIMITED (GB) 2012-05-24 WO claimed
US-7118730-B2 Quinoline derivative as diagnostic probe for disease with tau protein accumulation BF RESEARCH INSTITUTE, INC. (JP) 2006-10-10 US claimed
US-9040021-B2 Heterocyclic compounds as imaging probes of tau pathology GE HEALTHCARE LIMITED (GB) 2015-05-26 US disclosed
EP-2640703-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE Healthcare UK Limited (GB) 2013-09-25 EP disclosed
US-20130236395-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE HEALTHCARE LIMITED (GB) 2013-09-12 US disclosed
WO-2012067863-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY GE HEALTHCARE LIMITED (GB) 2012-05-24 WO disclosed
US-7118730-B2 Quinoline derivative as diagnostic probe for disease with tau protein accumulation BF RESEARCH INSTITUTE, INC. (JP) 2006-10-10 US disclosed
US-20050009865-A1 Quinoline derivative as diagnostic probe for disease with tau protein accumulation BF RESEARCH INSTITUTE, INC. (JP) 2005-01-13 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-20050009865-A1 Quinoline derivative as diagnostic probe for disease with tau protein accumulation MAPT, APP, PSEN1 APP 2/4885MAOA 1618/4885MAOB 1111/4885
US-20130236395-A1 HETEROCYCLIC COMPOUNDS AS IMAGING PROBES OF TAU PATHOLOGY MAPT, PSEN1, PSEN2 APP 4/4885MAOA 57/4885MAOB 28/4885

“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.