SCHEMBL19690977

SCHEMBL19690977

CC(=O)N1CCN(c2cc(-n3nc(C)cc3C)nc(Nc3cccc(C(F)(F)F)c3)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.50
MAPT P10636 2/20 0.48
TP53 P04637 1/20 0.48
IDH2 P48735 8/20 0.47
LMNA P02545 1/20 0.46
RECQL P46063 1/20 0.46
TRPV1 Q8NER1 1/20 0.45
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
EPHX2 P34913 1/20 0.45
BRD4 O60885 1/20 0.44
EP300 Q09472 1/20 0.44
CREBBP Q92793 1/20 0.44
APP P05067 1/20 0.44
RAF1 P04049 1/20 0.43
BRAF P15056 1/20 0.43

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
SCHEMBL19691074 0.88 AURKA (0.48) MAPTLMNATRPV1SMN1; SMN2EP300
SCHEMBL19690988 0.85 CTSC (0.53) CTSCMAPTTP53LMNARECQL
SCHEMBL19690833 0.85 ADORA2A (0.52) CTSCMAPTTP53LMNARECQL
SCHEMBL19690893 0.83 AURKA (0.47) SMN1; SMN2
SCHEMBL19690913 0.82 HTT (0.48) MAPTRECQLSMN1; SMN2
SCHEMBL19690986 0.81 GBA1 (0.44) MAPTLMNASMN1; SMN2
SCHEMBL19690989 0.81 MAPT (0.52) MAPTTP53IDH2LMNARECQL
SCHEMBL19690912 0.80 BPTF (0.43) SMN1; SMN2
SCHEMBL19691073 0.79 SMN1; SMN2 (0.41) MAPTTP53LMNASMN1; SMN2
SCHEMBL19691024 0.79 BPTF (0.43) USP2SMN1; SMN2CREBBP

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-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US 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 (1 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-20170355708-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 CTSC 2402/4885MAPT 1877/4885TP53 4484/4885

“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.