SCHEMBL19686878

SCHEMBL19686878

CC(C)C(Nc1cc(Cl)nc(NC2CCC(F)(F)CC2)c1)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 7/20 0.45
IDH2 P48735 3/20 0.37
CNR1 P21554 2/20 0.35
PRCP P42785 1/20 0.34
MAPK8 P45983 1/20 0.33
ROCK2 O75116 1/20 0.33
SYK P43405 1/20 0.32
KDM1A O60341 2/20 0.32
MAPK1 P28482 1/20 0.32
ABCB1 P08183 1/20 0.32
MAPK3 P27361 1/20 0.32
MAOB P27338 1/20 0.31
CYP2C9 P11712 1/20 0.31
NPR3 P17342 1/20 0.31
CYP2C19 P33261 1/20 0.31
CNR2 P34972 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
SCHEMBL19686884 0.89 IDH1 (0.45) IDH1IDH2CNR1PRCPMAPK1
SCHEMBL19686885 0.86 IDH1 (0.38) IDH1IDH2MAPK8ROCK2SYK
SCHEMBL19686612 0.80 KCNN2 (0.39) IDH1SYKKDM1AMAPK1
SCHEMBL21143813 0.78 IDH1 (0.41) IDH1IDH2CNR1MAPK1MAPK3
SCHEMBL19686879 0.77 S1PR2 (0.46) SYK
SCHEMBL31127253 0.75 IDH1 (0.41) IDH1IDH2CNR1SYKMAPK1
SCHEMBL21166186 0.75 IDH1 (0.41) IDH1IDH2CNR1SYKMAPK1
SCHEMBL21143642 0.74 IDH1 (0.39) IDH1IDH2CNR1PRCPMAPK8
SCHEMBL21143647 0.74 IDH1 (0.45) IDH1IDH2CNR1PRCPKDM1A
SCHEMBL19686593 0.73 KCNN2 (0.49) IDH1MAPK1CYP2C19

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 3017/4885IDH2 2447/4885CNR1 770/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885CNR1 770/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885CNR1 770/4885

“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.