SCHEMBL6710481

SCHEMBL6710481

Cn1c(C(=O)Nc2ccc(Cl)cc2-c2nnn[nH]2)cc2cccc(OCC3CCC3)c21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 7/20 0.37
KDM1A O60341 4/20 0.36
CHRM3 P20309 6/20 0.36
RCOR1 Q9UKL0 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
GRM4 Q14833 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL6713351 0.98 PTGER1 (0.38) PTGER1KDM1ACHRM3RCOR1CNR1
SCHEMBL6710394 0.97 KDM1A (0.37) PTGER1KDM1ACHRM3RCOR1GRM4
SCHEMBL6713780 0.91 KDM1A (0.36) PTGER1KDM1ARCOR1
SCHEMBL6711750 0.90 KDM1A (0.39) KDM1ACHRM3RCOR1
SCHEMBL6713385 0.89 PTGER1 (0.38) PTGER1KDM1ARCOR1
SCHEMBL6710444 0.89 PTGER1 (0.40) PTGER1GRM4
SCHEMBL6713781 0.89 KDM1A (0.38) KDM1ACHRM3GRM4
SCHEMBL6708000 0.88 KDM1A (0.37) PTGER1KDM1ARCOR1
SCHEMBL6710156 0.88 KDM1A (0.38) KDM1ACHRM3RCOR1
SCHEMBL6707977 0.87 IRAK4 (0.37) GRM4

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 PTGER1 3857/4885KDM1A 620/4885CHRM3 4862/4885

“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.