SCHEMBL19690897

SCHEMBL19690897

Fc1ccc(Nc2cc(Cl)nc(-n3ccc(C4CC4)n3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.40
▸ CCNE1 P24864 8/20 0.37
▸ CDK2 P24941 8/20 0.37
▸ KCNN3 Q9UGI6 3/20 0.36
▸ PDE10A Q9Y233 1/20 0.35
▸ BMI1 P35226 1/20 0.35
▸ KCNJ6 P48051 1/20 0.34
▸ KCNJ5 P48544 1/20 0.34
▸ KCNJ3 P48549 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ AGPAT2 O15120 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL19690905 0.86 POLB (0.57) POLBCCNE1CDK2KCNN3MAPT
SCHEMBL19691006 0.81 CCNE1 (0.48) CCNE1CDK2MAPTMEN1NPC1
SCHEMBL19690992 0.80 NPC1 (0.41) PDE10ASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL19690851 0.77 IDH1 (0.44) POLBCCNE1CDK2KCNN3ALOX5
SCHEMBL19690895 0.76 POLB (0.45) POLBCCNE1CDK2KCNN3ALOX5
SCHEMBL21144351 0.76 IDH1 (0.47) —
SCHEMBL31127241 0.76 IDH1 (0.47) —
SCHEMBL19708733 0.72 POLB (0.38) POLBCCNE1CDK2KCNN3ALOX5
SCHEMBL19690868 0.72 ALDH1A1 (0.45) POLBKCNN3MAPTSMN1; SMN2MEN1
SCHEMBL4880624 0.68 TXN (0.53) POLBALOX5PPARGMAPTSMN1; SMN2

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 POLB 4779/4885CCNE1 4852/4885CDK2 4182/4885

“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.

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