SCHEMBL19687090

SCHEMBL19687090

CC(=O)NCc1cc(NC2CCC(F)(F)CC2)nc(-c2nc(CF)cs2)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 9/20 0.35
KDM1A O60341 2/20 0.34
IDH2 P48735 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CCNT1 O60563 3/20 0.33
RORC P51449 1/20 0.32
CCNK O75909 1/20 0.31
CDK9 P50750 1/20 0.31
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL31127291 1.00 IDH1 (0.35) IDH1KDM1AIDH2NPC1RAB9A
SCHEMBL21144044 0.93 IDH1 (0.35) IDH1KDM1AIDH2NPC1RAB9A
SCHEMBL31127387 0.90 IDH1 (0.36) IDH1KDM1AIDH2NPC1RAB9A
SCHEMBL19687097 0.90 IDH1 (0.36) IDH1KDM1AIDH2NPC1RAB9A
SCHEMBL31127269 0.84 FABP4 (0.41) IDH1IDH2NPC1RAB9ACCNT1
SCHEMBL21143597 0.84 FABP4 (0.41) IDH1IDH2NPC1RAB9ACCNT1
SCHEMBL19687423 0.81 TGFBR1 (0.35) IDH1KDM1AIDH2CCNT1
SCHEMBL21144173 0.78 IDH1 (0.40) IDH1IDH2CCNT1MAPK1
SCHEMBL21143894 0.77 IDH1 (0.39) IDH1IDH2CCNT1
SCHEMBL19686343 0.76 IDH1 (0.35) IDH1KDM1ACCNT1RORCCDK9

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 IDH1 3017/4885KDM1A 1088/4885IDH2 2447/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885KDM1A 1088/4885IDH2 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.