SCHEMBL6710106

SCHEMBL6710106

Cn1c(C(=O)Nc2ccc(Cl)cc2-c2nnn[nH]2)cc2ccc(OCC3CCC3)cc21

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 15/20 0.42
RCOR1 Q9UKL0 5/20 0.38
RXFP1 Q9HBX9 1/20 0.36
GRM4 Q14833 1/20 0.36
GCGR P47871 1/20 0.35
MCHR1 Q99705 2/20 0.35

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
SCHEMBL6711941 0.97 KDM1A (0.42) KDM1ARCOR1RXFP1GRM4MCHR1
SCHEMBL6713361 0.91 KDM1A (0.41) KDM1ARCOR1GCGRMCHR1
SCHEMBL6707752 0.90 KDM1A (0.43) KDM1ARCOR1GCGRMCHR1
SCHEMBL6708937 0.88 KDM1A (0.42) KDM1ARCOR1MCHR1
SCHEMBL6709851 0.87 RXFP1 (0.39) KDM1ARXFP1GRM4
SCHEMBL6714039 0.86 KDM1A (0.44) KDM1ARCOR1MCHR1
SCHEMBL6707804 0.85 MAPT (0.43) KDM1ARXFP1GRM4
SCHEMBL6708850 0.85 KDM1A (0.41) KDM1ARCOR1RXFP1GRM4
SCHEMBL6712525 0.85 SRD5A2 (0.44) KDM1ARCOR1RXFP1GRM4
SCHEMBL6710481 0.84 PTGER1 (0.37) KDM1ARCOR1GRM4

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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 (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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 KDM1A 620/4885RCOR1 3366/4885RXFP1 3836/4885

“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.