SCHEMBL1459345

SCHEMBL1459345

CCCc1ccc2cc(C(=O)NC3CN4CCC3CC4)ccc2n1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 6/20 0.63
CHRNA7 P36544 10/20 0.58
HTR3E A5X5Y0 4/20 0.57
HTR3B O95264 4/20 0.57
HTR3D Q70Z44 4/20 0.57
HTR3C Q8WXA8 4/20 0.57
CYP2D6 P10635 1/20 0.57
CHRNB4 P30926 3/20 0.54
CHRNA3 P32297 3/20 0.54
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
GRM1 Q13255 1/20 0.50
CHRNB2 P17787 1/20 0.48
CHRNA4 P43681 1/20 0.48

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
SCHEMBL1459324 0.93 CHRNA7 (0.64) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL1458636 0.92 HTR3A (0.66) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL1459350 0.84 CHRNA7 (0.67) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL1459684 0.84 HTR3A (0.69) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL1459352 0.79 HTR3A (0.57) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL1459742 0.78 HTR3A (0.67) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL2229770 0.78 CHRNA7 (0.66) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL2229779 0.78 CHRNA7 (0.66) HTR3ACHRNA7HTR3EHTR3BHTR3D
SCHEMBL5264415 0.78 HTR3A (0.61) HTR3A
SCHEMBL6631146 0.78 CHRNA7 (0.60) HTR3ACHRNA7HTR3EHTR3BHTR3D

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190040057-A1 HETEROARYL CARBOXAMIDES BAYER HEALTHCARE AG (DE) 2019-02-07 US claimed
US-20160214975-A1 HETEROARYL CARBOXAMIDES BAYER HEALTHCARE AG (DE) 2016-07-28 US claimed
US-20130144062-A1 HETEROARYL CARBOXAMIDES Bayer Pharma AG (DE) 2013-06-06 US claimed
US-8227598-B2 Heteroaryl carboxamides BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-07-24 US claimed
US-20080009624-A1 Heteroaryl carboxamides BAYER HEALTHCARE AG (DE) 2008-01-10 US claimed
US-12215387-B2 Biomarker predictive of responsiveness to alpha 7 nicotinic acetylcholine receptor activator treatment NOVARTIS AG (CH) 2025-02-04 US disclosed
US-20220316011-A1 BIOMARKER PREDICTIVE OF RESPONSIVENESS TO ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVATOR TREATMENT NOVARTIS AG (CH) 2022-10-06 US disclosed
US-11359241-B2 Biomarkers predictive of responsiveness to alpha 7 nicotinic acetylcholine receptor activator treatment NOVARTIS AG (CH) 2022-06-14 US disclosed
US-20210338621-A1 USE OF NICOTINIC ACETYLCHOLINE RECEPTOR ALPHA 7 ACTIVATORS NOVARTIS AG (CH) 2021-11-04 US disclosed
US-20200108035-A1 USE OF NICOTINIC ACETYLCHOLINE RECEPTOR ALPHA 7 ACTIVATORS NOVARTIS AG (CH) 2020-04-09 US disclosed
US-20190040057-A1 HETEROARYL CARBOXAMIDES BAYER HEALTHCARE AG (DE) 2019-02-07 US disclosed
US-20190040057-A1 HETEROARYL CARBOXAMIDES BAYER HEALTHCARE AG (DE) 2019-02-07 US disclosed
US-20080009624-A1 Heteroaryl carboxamides BAYER HEALTHCARE AG (DE) 2008-01-10 US disclosed
US-20080009624-A1 Heteroaryl carboxamides BAYER HEALTHCARE AG (DE) 2008-01-10 US disclosed
US-20080009624-A1 Heteroaryl carboxamides BAYER HEALTHCARE AG (DE) 2008-01-10 US disclosed
EP-1448530-B1 HETEROARYL CARBOXYLIC ACID AMIDES BAYER HEALTHCARE AG (DE) 2007-10-03 EP disclosed
US-7256288-B2 Heteroaryl carboxylic acid amides BAYER HEALTHCARE AG (DE) 2007-08-14 US disclosed
US-7256288-B2 Heteroaryl carboxylic acid amides BAYER HEALTHCARE AG (DE) 2007-08-14 US disclosed
US-7256288-B2 Heteroaryl carboxylic acid amides BAYER HEALTHCARE AG (DE) 2007-08-14 US disclosed
US-20050209236-A1 Heteroaryl carboxylic acid amides BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2005-09-22 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 (10 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-20130144062-A1 HETEROARYL CARBOXAMIDES GRIN2A, GRIN2C, CNR2 HTR3A 318/4885CHRNA7 41/4885HTR3E 322/4885
US-20160214975-A1 HETEROARYL CARBOXAMIDES GRIN2A, GRIN2C, CNR2 HTR3A 318/4885CHRNA7 41/4885HTR3E 322/4885
US-20190040057-A1 HETEROARYL CARBOXAMIDES CNR2, GRIN2A, CNR1 HTR3A 194/4885CHRNA7 52/4885HTR3E 252/4885
US-20050209236-A1 Heteroaryl carboxylic acid amides HCAR2, HCAR1, HCAR3 HTR3A 536/4885CHRNA7 153/4885HTR3E 1131/4885
US-12215387-B2 Biomarker predictive of responsiveness to alpha 7 nicotinic acetylcholine receptor activator treatment CHRNA7, CHRNA4, CHRNA5 HTR3A 131/4885CHRNA7 1/4885HTR3E 200/4885
US-20220316011-A1 BIOMARKER PREDICTIVE OF RESPONSIVENESS TO ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVATOR TREATMENT CHRNA7, CHRNA4, CHRNA5 HTR3A 131/4885CHRNA7 1/4885HTR3E 200/4885
US-20200108035-A1 USE OF NICOTINIC ACETYLCHOLINE RECEPTOR ALPHA 7 ACTIVATORS CHRNA7, CHRNA5, CHRNA4 HTR3A 151/4885CHRNA7 1/4885HTR3E 416/4885
US-20080009624-A1 Heteroaryl carboxamides GRIN2A, GRIN2C, CNR2 HTR3A 318/4885CHRNA7 41/4885HTR3E 322/4885
US-11359241-B2 Biomarkers predictive of responsiveness to alpha 7 nicotinic acetylcholine receptor activator treatment CHRNA7, CHRNA4, CHRNA5 HTR3A 112/4885CHRNA7 1/4885HTR3E 177/4885
US-20210338621-A1 USE OF NICOTINIC ACETYLCHOLINE RECEPTOR ALPHA 7 ACTIVATORS CHRNA7, CHRNA5, CHRNA4 HTR3A 151/4885CHRNA7 1/4885HTR3E 416/4885

“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.