SCHEMBL10074404

SCHEMBL10074404

CC[C@@H](C)Nc1nc2c(C)cccn2c(=O)c1NC(=O)CC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RCE1 Q9Y256 1/20 0.46
TP53 P04637 3/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.38
THRB P10828 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
SCHEMBL883703 0.91 LMNA (0.44) KDM4EMEN1KMT2ARCE1TP53
SCHEMBL15106487 0.86 TP53 (0.38) KDM4EMEN1KMT2ARCE1TP53
SCHEMBL875494 0.80 KDM4E (0.50) KDM4EMEN1KMT2ATP53HSD17B10
SCHEMBL876306 0.78 SMN1; SMN2 (0.40) KMT2ATP53HPGDMAPTSMN1; SMN2
SCHEMBL15106118 0.76 KCNQ2 (0.36) KMT2ALMNAMAPTSMN1; SMN2POLB
SCHEMBL883352 0.68 KCNQ3 (0.37) KMT2ATP53HPGDMAPTSMN1; SMN2
SCHEMBL877424 0.68 KCNQ2 (0.38) KDM4E
SCHEMBL875449 0.67 SMN1; SMN2 (0.42) KDM4EMEN1KMT2ATP53HPGD
SCHEMBL4944588 0.67 HDAC3 (0.60) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL875789 0.67 LMNA (0.42) KDM4EMEN1KMT2ARCE1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases PFIZER INC. (US) 2013-07-18 US disclosed
US-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases PFIZER INC. (US) 2013-07-18 US disclosed
WO-2012038850-A1 PYRIDMIDONES FOR TREATMENT OF POTASSIUM CHANNEL RELATED DISEASES PFIZER INC. (US) 2012-03-29 WO 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-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases KCNQ5, KCNQ1, KCNQ3 KDM4E 2185/4885MEN1 1516/4885KMT2A 1085/4885

“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.