SCHEMBL18378709

SCHEMBL18378709

Cc1cn(C2CNC2)nn1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.38
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
KCNH2 Q12809 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL18378710 0.85 KDM5A (0.38) KDM5AHTR2AHTR2CHTR2B
SCHEMBL18378778 0.85 KDM5A (0.38) KDM5AHTR2AHTR2CHTR2B
SCHEMBL8131168 0.85 KDM5A (0.38) KDM5AHTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL8130094 0.84 KDM5A (0.37) KDM5AHTR2AHTR2CHTR2B
SCHEMBL18377666 0.81 KDM5A (0.32) KDM5A
SCHEMBL15383467 0.81 CHRNB2 (0.44) KDM5AHTR2CIRAK4
SCHEMBL18377698 0.81 KDM5A (0.32) KDM5A
SCHEMBL18377857 0.79 TLR8 (0.41) KDM5A
SCHEMBL18164082 0.78 IDO1 (0.40) KDM5AKCNH2
SCHEMBL18377658 0.78 IDO1 (0.43) KDM5A

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-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 US disclosed
US-20170008873-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-01-12 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-20170008873-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS KDM5A 1081/4885HTR2A 2432/4885HTR2C 3023/4885

“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.