SCHEMBL20746846

SCHEMBL20746846

CC(C)c1cccc(C2NN=NN2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 2/20 0.38
▸ HDAC8 Q9BY41 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MDM4 O15151 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TYR P14679 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MDM2 Q00987 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38

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
SCHEMBL15566600 0.71 HTR2C (0.43) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL19933173 0.70 HDAC4 (0.38) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL25094188 0.70 CHRNB2 (0.49) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL374780 0.70 HDAC4 (0.56) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL15281737 0.68 TSHR (0.48) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL7634263 0.68 HDAC4 (0.47) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL1364527 0.68 HTR2C (0.38) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL30272547 0.68 CHRNB2 (0.43) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL24291779 0.68 HDAC4 (0.36) HDAC4HDAC8KDM4ESMN1; SMN2MDM4
SCHEMBL12278164 0.68 HTR2C (0.62) —

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-10206931-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-19 — — 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-10206931-B2 Therapeutic compounds and uses thereof EP300, CREBBP, HDAC1 HDAC4 22/4885HDAC8 34/4885KDM4E 387/4885

“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.

Send feedback