SCHEMBL16688159

SCHEMBL16688159

Cc1cc(C2=NOC(C)(c3cc(Cl)cc(Cl)c3)C2)ccc1C(=O)N1CC(=O)NC(=O)C1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.37
KDM4E B2RXH2 5/20 0.36
PTGDR2 Q9Y5Y4 9/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
RECQL P46063 1/20 0.34
MAPT P10636 2/20 0.34
ATM Q13315 1/20 0.32

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
SCHEMBL16688220 0.95 PKM (0.38) PKMKDM4EPTGDR2CA1CA2
SCHEMBL18082523 0.91 PTGDR2 (0.38) PKMKDM4EPTGDR2CA1CA2
SCHEMBL16688200 0.90 KDM4E (0.36) PKMKDM4EPTGDR2CA1CA2
SCHEMBL16688169 0.88 KDM4E (0.34) PKMKDM4EPTGDR2CA1CA2
SCHEMBL18082518 0.87 PTGDR2 (0.35) PKMKDM4EPTGDR2CA1CA2
SCHEMBL16688210 0.87 PTGDR2 (0.35) PKMKDM4EPTGDR2CA1CA2
SCHEMBL16688175 0.87 HRH4 (0.38) KDM4ECA1CA2RECQL
SCHEMBL16688193 0.86 PTGDR2 (0.35) PKMKDM4EPTGDR2CA1CA2
SCHEMBL16689438 0.85 PKM (0.35) PKMCA1CA2RECQLMAPT
SCHEMBL16688152 0.85 PTGDR2 (0.36) KDM4EPTGDR2CA1CA2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447084-B2 Antiparisitic and pesticidal isoxazoline compounds MERIAL, INC. (US) 2016-09-20 US disclosed
US-20150126523-A1 ANTIPARISITIC AND PESTICIDAL ISOXAZOLINE COMPOUNDS MERIAL LIMITED (US) 2015-05-07 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-20150126523-A1 ANTIPARISITIC AND PESTICIDAL ISOXAZOLINE COMPOUNDS ACHE, PRDX1, CHRM1 PKM 1835/4885KDM4E 2875/4885PTGDR2 634/4885

“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.