SCHEMBL19686445

SCHEMBL19686445

Cc1ccnn1-c1cc(C#N)cc(NC2CCC(F)(F)CC2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 1/20 0.37
PRKD2 Q9BZL6 1/20 0.37
IRAK4 Q9NWZ3 3/20 0.37
EGLN2 Q96KS0 2/20 0.36
IDH1 O75874 7/20 0.36
MAP3K12 Q12852 5/20 0.35
DLK1 P80370 1/20 0.33
DRG1 Q9Y295 1/20 0.33
IDH2 P48735 1/20 0.33
CCNK O75909 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK12 Q9NYV4 1/20 0.33
MAP3K13 O43283 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
MAP3K9 P80192 1/20 0.33
MAP3K10 Q02779 1/20 0.33
MAP3K11 Q16584 1/20 0.33

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
SCHEMBL31127391 1.00 PRKD1 (0.37) PRKD1PRKD2IRAK4EGLN2IDH1
SCHEMBL19686941 0.84 KCNN2 (0.46) IRAK4IDH1
SCHEMBL31127312 0.84 KCNN2 (0.46) IRAK4IDH1
SCHEMBL19686406 0.79 IDH1 (0.40) PRKD1PRKD2IRAK4EGLN2IDH1
SCHEMBL21166132 0.76 IDH1 (0.46) IDH1IDH2
SCHEMBL19686794 0.76 ADORA2A (0.44)
SCHEMBL21166254 0.73 IDH1 (0.43) IRAK4EGLN2IDH1IDH2CCR6
SCHEMBL21166253 0.73 IDH1 (0.58) IDH1IDH2
SCHEMBL19687339 0.73 RAF1 (0.44) IDH1IDH2
SCHEMBL31127345 0.73 IDH1 (0.58) IDH1IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 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 (2 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 PRKD1 1908/4885PRKD2 1610/4885IRAK4 1952/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PRKD1 1908/4885PRKD2 1610/4885IRAK4 1952/4885

“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.