SCHEMBL19687364

SCHEMBL19687364

Cc1cc(NC2CCC(F)(F)CC2)nc(-n2ccc(OCc3ccccc3)n2)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 9/20 0.41
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNN2 Q9H2S1 1/20 0.37
KCNN3 Q9UGI6 1/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPK8 P45983 1/20 0.34
CCNT1 O60563 3/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL21144107 0.88 IDH1 (0.44) IDH1SMN1; SMN2KCNN2KCNN3
SCHEMBL19686985 0.85 IDH1 (0.47) IDH1KCNN2KCNN3
SCHEMBL19687027 0.83 IDH1 (0.45) IDH1KCNN2KCNN3
SCHEMBL19686976 0.82 IDH1 (0.44) IDH1KCNN2KCNN3
SCHEMBL19686279 0.81 IDH1 (0.51) IDH1LMNACYP1A2CYP2D6HTT
SCHEMBL19686970 0.81 IDH1 (0.45) IDH1LMNACYP1A2CYP2D6HTT
SCHEMBL21144026 0.79 IDH1 (0.37) IDH1LMNACYP1A2CYP2D6HTT
SCHEMBL31127031 0.79 IDH1 (0.37) IDH1LMNACYP1A2CYP2D6HTT
SCHEMBL19686311 0.79 IDH1 (0.47) IDH1LMNACYP1A2CYP2D6HTT
SCHEMBL19686600 0.79 IDH1 (0.47) IDH1LMNACYP1A2CYP2D6HTT

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 3017/4885LMNA 1529/4885CYP1A2 1148/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885LMNA 1529/4885CYP1A2 1148/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885LMNA 1529/4885CYP1A2 1148/4885

“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.