SCHEMBL30997796

SCHEMBL30997796

Cc1ccnc(C2(F)CC2)n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.32
▸ UHRF1 Q96T88 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ AOC3 Q16853 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ CRBN Q96SW2 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
SCHEMBL13782273 0.78 ALOX15 (0.33) ALOX15UHRF1KMT2AKDM4ENPSR1
SCHEMBL2141684 0.76 KMT2A (0.38) ALOX15UHRF1KMT2AKDM4ENPSR1
SCHEMBL23706250 0.76 — —
SCHEMBL23705835 0.76 — —
SCHEMBL26141058 0.76 IDH1 (0.33) —
SCHEMBL30282350 0.72 GRM5 (0.32) —
SCHEMBL27945168 0.72 — —
SCHEMBL29155747 0.69 KMT2A (0.46) ALOX15KMT2AKDM4E
SCHEMBL26141704 0.69 GRM5 (0.32) ALOX15
SCHEMBL31658602 0.69 ALOX15 (0.37) ALOX15KMT2AKDM4ECRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 — — 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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK5, KLK1 ALOX15 1029/4885UHRF1 3776/4885KMT2A 1222/4885

“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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