SCHEMBL30190703

SCHEMBL30190703

C=CC(=O)Nc1cccc(-c2ccc3c(C)cc(N)nc3c2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 5/20 0.53
▸ ITK Q08881 3/20 0.53
▸ NOS1 P29475 4/20 0.52
▸ NOS3 P29474 3/20 0.52
▸ NOS2 P35228 2/20 0.52
▸ MAP2K7 O14733 2/20 0.51
▸ JAK3 P52333 2/20 0.49
▸ GAK O14976 1/20 0.49
▸ PLCG1 P19174 2/20 0.48
▸ JAK1 P23458 1/20 0.47
▸ AURKA O14965 1/20 0.47

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
SCHEMBL24150360 1.00 BTK (0.53) BTKITKNOS1NOS3NOS2
SCHEMBL30190650 0.83 JAK3 (0.55) BTKITKMAP2K7JAK3GAK
SCHEMBL24150339 0.83 JAK3 (0.55) BTKITKMAP2K7JAK3GAK
SCHEMBL30190678 0.82 DHFR (0.60) BTKITKMAP2K7JAK3GAK
SCHEMBL24151412 0.82 BTK (0.57) BTKITKMAP2K7JAK3GAK
SCHEMBL30190863 0.82 BTK (0.57) BTKITKMAP2K7JAK3GAK
SCHEMBL24150553 0.82 DHFR (0.60) BTKITKMAP2K7JAK3GAK
SCHEMBL30190649 0.80 JAK3 (0.63) BTKITKJAK3GAKPLCG1
SCHEMBL24150554 0.80 JAK3 (0.63) BTKITKJAK3GAKPLCG1
SCHEMBL24151245 0.79 MAP2K7 (0.50) BTKITKMAP2K7JAK3GAK

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-11926632-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2024-03-12 — — US disclosed
US-20230046427-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. 2023-02-16 — — 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-20230046427-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION TP53, TP53BP1, HRAS BTK 4194/4885ITK 4359/4885NOS1 3609/4885
US-11926632-B2 Methods and compounds for restoring mutant p53 function TP53, TP53BP1, HRAS BTK 4194/4885ITK 4359/4885NOS1 3609/4885

“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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