SCHEMBL19687058

SCHEMBL19687058

Cc1ccn(-c2cc(COc3ccc(F)cn3)cc(NC3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 5/20 0.40
HCRTR2 O43614 5/20 0.40
CCNT1 O60563 3/20 0.34
GRM5 P41594 3/20 0.34
IDH1 O75874 1/20 0.33
BRD4 O60885 1/20 0.33
CXCR2 P25025 1/20 0.33

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
SCHEMBL19687063 0.91 CCNT1 (0.35) HCRTR1HCRTR2CCNT1IDH1
SCHEMBL19687064 0.89 SLC34A1 (0.38) HCRTR1HCRTR2IDH1
SCHEMBL31127355 0.88 GABRA1 (0.35) HCRTR1HCRTR2CCNT1IDH1BRD4
SCHEMBL19686410 0.88 GABRA1 (0.35) HCRTR1HCRTR2CCNT1IDH1BRD4
SCHEMBL19686407 0.85 IDH1 (0.38) CCNT1IDH1
SCHEMBL19687146 0.84 IDH1 (0.33) CCNT1IDH1
SCHEMBL19687057 0.84 IDH1 (0.34) CCNT1IDH1
SCHEMBL19687062 0.84 IDH1 (0.36) IDH1
SCHEMBL19687060 0.82 GABRA1 (0.40) HCRTR1HCRTR2IDH1BRD4
SCHEMBL21144169 0.82 IDH1 (0.40) CCNT1IDH1BRD4

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 HCRTR1 2875/4885HCRTR2 2487/4885CCNT1 4771/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 HCRTR1 2875/4885HCRTR2 2487/4885CCNT1 4771/4885

“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.