SCHEMBL21144189

SCHEMBL21144189

Cc1ccn(-c2nc(NC(=O)OC3CCC(F)(F)CC3)cc(C3COCCC3(F)F)n2)n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIF18A Q8NI77 6/20 0.33
MAP4K1 Q92918 3/20 0.33
PTGER1 P34995 1/20 0.32
GCK P35557 1/20 0.32
GRM5 P41594 3/20 0.32
IDH1 O75874 1/20 0.32
FASN P49327 4/20 0.31

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
SCHEMBL21143625 0.87 MAP4K1 (0.35) KIF18AMAP4K1PTGER1GRM5FASN
SCHEMBL21143596 0.87 KIF18A (0.33) KIF18AMAP4K1PTGER1GRM5FASN
SCHEMBL19686613 0.83 IDH1 (0.43) IDH1
SCHEMBL21144188 0.77 IDH1 (0.33) IDH1
SCHEMBL19687205 0.75 IDH1 (0.32) IDH1
SCHEMBL21143704 0.74 ADORA2A (0.41)
SCHEMBL21143690 0.73 ADORA2A (0.43)
SCHEMBL21144226 0.73 ADORA2A (0.41)
SCHEMBL19686328 0.70 IDH1 (0.40) KIF18AIDH1
SCHEMBL19686818 0.67 IDH1 (0.47) IDH1

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 2 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

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 KIF18A 691/4885MAP4K1 343/4885PTGER1 762/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 KIF18A 691/4885MAP4K1 343/4885PTGER1 762/4885

“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.