SCHEMBL19687300

SCHEMBL19687300

COc1ccn(-c2cc(N3CCN(C(C)=O)CC3)nc(NC3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 6/20 0.45
EPHX2 P34913 1/20 0.38
IDH2 P48735 1/20 0.37
MAPK8 P45983 3/20 0.37
GBA1 P04062 1/20 0.36
PDE10A Q9Y233 1/20 0.35
RAF1 P04049 1/20 0.35
ALK Q9UM73 2/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CDK2 P24941 1/20 0.35
HRH4 Q9H3N8 1/20 0.35
TPH1 P17752 1/20 0.35
SYK P43405 1/20 0.35

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
SCHEMBL19687329 0.89 IDH1 (0.47) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL19687327 0.88 IDH1 (0.47) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL21143852 0.88 IDH1 (0.47) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL19687303 0.88 IDH1 (0.47) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL19686369 0.86 IDH1 (0.46) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL21144270 0.86 IDH1 (0.46) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL19686963 0.86 IDH1 (0.48) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL31127035 0.86 IDH1 (0.46) IDH1EPHX2IDH2MAPK8GBA1
SCHEMBL21165816 0.86 IDH1 (0.59) IDH1IDH2
SCHEMBL19686371 0.86 IDH1 (0.45) IDH1EPHX2IDH2MAPK8GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
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 (3 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885EPHX2 4064/4885IDH2 2447/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885EPHX2 4064/4885IDH2 2447/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885EPHX2 4064/4885IDH2 2447/4885

“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.