SCHEMBL26922239

SCHEMBL26922239

Nc1nonc1-c1nc2cccc(F)c2n1Cc1ccncn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNK13 Q9HB14 14/20 1.00
ALDH1A1 P00352 2/20 0.47
TSHR P16473 2/20 0.47
HTT P42858 2/20 0.47
TP53 P04637 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
DYRK1A Q13627 1/20 0.45
RPS6KA5 O75582 1/20 0.44

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
SCHEMBL29995472 1.00 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL29995154 0.86 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL26922690 0.86 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL29995758 0.85 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL26922920 0.85 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL26921287 0.84 KCNK13 (0.74) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL29995770 0.84 KCNK13 (0.74) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL26921718 0.83 KCNK13 (0.72) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL29995802 0.83 KCNK13 (0.72) KCNK13ALDH1A1TSHRHTTTP53
SCHEMBL29995185 0.82 KCNK13 (1.00) KCNK13ALDH1A1TSHRHTTTP53

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158385-A1 NOVEL COMPOUNDS Cerevance, Inc. 2024-05-16 US claimed
EP-4288433-A1 NOVEL COMPOUNDS Cerevance, Inc. (US) 2023-12-13 EP claimed
US-20240158385-A1 NOVEL COMPOUNDS Cerevance, Inc. 2024-05-16 US disclosed
EP-4288433-A1 NOVEL COMPOUNDS Cerevance, Inc. (US) 2023-12-13 EP 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-20240158385-A1 NOVEL COMPOUNDS KCNK3, KCNA4, KCNK13 KCNK13 3/4885ALDH1A1 2143/4885TSHR 2243/4885

“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.