SCHEMBL19687434

SCHEMBL19687434

COCCOCc1cc(NC2CCC(F)(F)CC2)nc(-n2ccc(C)n2)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 5/20 0.35
PDE2A O00408 1/20 0.33
CNR1 P21554 1/20 0.31
P2RX7 Q99572 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL21165912 0.85 IDH1 (0.34) IDH1PDE2A
SCHEMBL19687351 0.85 IDH1 (0.40) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL21144169 0.85 IDH1 (0.40) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL31127144 0.85 IDH1 (0.40) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL19686405 0.84 IDH1 (0.39) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL19687079 0.84 IDH1 (0.39) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL31127120 0.84 IDH1 (0.39) IDH1PDE2ANPC1MAPTRAB9A
SCHEMBL31127359 0.83 IDH1 (0.35) IDH1CNR1
SCHEMBL19687101 0.83 IDH1 (0.35) IDH1CNR1
SCHEMBL21165983 0.83 IDH1 (0.39) IDH1PDE2ANPC1MAPTRAB9A

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-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
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 3017/4885PDE2A 758/4885CNR1 770/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885PDE2A 758/4885CNR1 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.