SCHEMBL12978153

SCHEMBL12978153

CCN(C(=O)c1ccc(Sc2nc(OC)cc(OC)n2)cc1)c1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.49
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2B6 P20813 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ TRPV1 Q8NER1 1/20 0.39
▸ OXTR P30559 1/20 0.39
▸ HPGD P15428 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ ADAMTS4 O75173 1/20 0.37
▸ S1PR1 P21453 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL12978167 0.90 HTT (0.51) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL12978156 0.87 HTT (0.53) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL12978149 0.87 HTT (0.49) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL12978152 0.86 TRPV1 (0.48) TRPV1OXTRKDM4E
SCHEMBL12978145 0.82 SMN1; SMN2 (0.59) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL12977982 0.79 HTT (0.61) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL790954 0.79 HTT (0.51) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL790147 0.78 HTT (0.61) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL12977989 0.78 HTT (0.60) HTTCYP3A4CYP2C9CYP2B6CYP2C19
SCHEMBL15093652 0.78 HTT (0.47) HTTCYP3A4CYP2C9CYP2B6CYP2C19

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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 — — US disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 — — 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR HTT 2101/4885CYP3A4 87/4885CYP2C9 310/4885

“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.

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