SCHEMBL19686410

SCHEMBL19686410

Cc1ccc(OCc2cc(NC3CCC(F)(F)CC3)nc(-n3ccc(C)n3)c2)nn1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.35
IDH1 O75874 10/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
BRD4 O60885 1/20 0.31
CCNT1 O60563 1/20 0.30
PDE2A O00408 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
SCHEMBL31127355 1.00 GABRA1 (0.35) GABRA1IDH1HDAC1HDAC6HDAC5
SCHEMBL19687062 0.90 IDH1 (0.36) GABRA1IDH1
SCHEMBL19687146 0.89 IDH1 (0.33) GABRA1IDH1HDAC1HDAC6HDAC5
SCHEMBL19687060 0.89 GABRA1 (0.40) GABRA1IDH1HCRTR1HCRTR2BRD4
SCHEMBL19687058 0.88 HCRTR1 (0.40) IDH1HCRTR1HCRTR2BRD4CCNT1
SCHEMBL19686407 0.86 IDH1 (0.38) IDH1CCNT1PDE2A
SCHEMBL19687064 0.85 SLC34A1 (0.38) IDH1HCRTR1HCRTR2
SCHEMBL19687063 0.85 CCNT1 (0.35) IDH1HCRTR1HCRTR2CCNT1
SCHEMBL19687057 0.83 IDH1 (0.34) IDH1CCNT1PDE2A
SCHEMBL21144169 0.83 IDH1 (0.40) IDH1BRD4CCNT1PDE2A

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 GABRA1 325/4885IDH1 3017/4885HDAC1 819/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 GABRA1 325/4885IDH1 3017/4885HDAC1 819/4885

“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.