SCHEMBL6803867

SCHEMBL6803867

COc1cc(NC(=O)c2ccc(Br)cc2)ccc1OCCN1CCCC1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 9/20 0.78
ASF1A Q9Y294 1/20 0.62
KDR P35968 3/20 0.57
EGFR P00533 1/20 0.56
ABCB1 P08183 1/20 0.54
ABCG2 Q9UNQ0 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
MAPT P10636 1/20 0.53
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52

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
SCHEMBL1930791 0.86 MCHR1 (0.65) MCHR1ASF1AKDREGFRMEN1
SCHEMBL6925669 0.83 MCHR1 (0.93) MCHR1ASF1AKDREGFRHTR2C
SCHEMBL4256379 0.80 NPC1 (0.76) ABCB1MEN1KMT2AMAPT
SCHEMBL14618438 0.80 MCHR1 (0.79) MCHR1ASF1AKDRHTR2AHTR2C
SCHEMBL7056752 0.79 MCHR1 (0.52) MCHR1HTR2C
SCHEMBL2323789 0.79 LTA4H (0.66) MCHR1HTR2AHTR2CMEN1KMT2A
SCHEMBL14618441 0.79 MCHR1 (0.77) MCHR1ASF1AHTR2AHTR2CBCHE
SCHEMBL6174157 0.79 MCHR1 (0.62) MCHR1ASF1AMEN1KMT2AMAPT
SCHEMBL17560532 0.78 MCHR1 (0.64) MCHR1ASF1AHTR2AHTR2CBCHE
SCHEMBL6477726 0.78 MCHR1 (0.65) MCHR1ASF1AKDRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063686-A1 Carboxamide compounds and their use as antagonists of a human 11cby receptor JOHNSON CHRISTOPHER NORBERT (GB) 2004-04-01 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-20040063686-A1 Carboxamide compounds and their use as antagonists of a human 11cby receptor CNR1, GPR3, CCKAR MCHR1 133/4885ASF1A 4311/4885KDR 1785/4885

“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.