SCHEMBL19686398

SCHEMBL19686398

Cc1csc(-c2nc(NC3CCC(F)(F)CC3)cc(N3CC4(COC4)C3)n2)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 13/20 0.41
IDH2 P48735 1/20 0.36
FABP4 P15090 1/20 0.32
FABP5 Q01469 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
PDE10A Q9Y233 2/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
PIK3R2 O00459 1/20 0.30
HRH4 Q9H3N8 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
SCHEMBL21165963 0.89 IDH1 (0.42) IDH1IDH2FABP4FABP5ADORA2A
SCHEMBL19687035 0.88 IDH1 (0.40) IDH1IDH2
SCHEMBL19686649 0.87 IDH1 (0.44) IDH1IDH2IRAK4PDE10AADORA2A
SCHEMBL19686471 0.87 IDH1 (0.44) IDH1IDH2PDE10AHRH4
SCHEMBL19686472 0.85 IDH1 (0.44) IDH1IDH2PDE10AHRH4
SCHEMBL21165860 0.85 IDH1 (0.36) IDH1IDH2HRH4
SCHEMBL19686983 0.85 IDH1 (0.44) IDH1IDH2
SCHEMBL19686476 0.85 CHRM3 (0.46) IDH1IDH2PDE10AHRH4
SCHEMBL19686673 0.84 IDH1 (0.42) IDH1IDH2ADORA2AADORA1HRH4
SCHEMBL19686478 0.84 HRH4 (0.47) IDH1IDH2HRH4

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 IDH1 3017/4885IDH2 2447/4885FABP4 2531/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 IDH1 3017/4885IDH2 2447/4885FABP4 2531/4885

“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.