SCHEMBL23928440

SCHEMBL23928440

NC(=O)Nc1cnc(-c2ncco2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 7/20 0.46
▸ ADORA2A P29274 3/20 0.37
▸ ADORA2B P29275 3/20 0.37
▸ TRPM4 Q8TD43 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ NR3C2 P08235 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CFTR P13569 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ADORA1 P30542 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
SCHEMBL20265568 0.88 MALT1 (0.47) MALT1ADORA2AADORA2BTRPM4NPC1
SCHEMBL23928432 0.81 CFTR (0.44) MALT1ADORA2AADORA2BADORA3CYP2C19
SCHEMBL20283653 0.80 MALT1 (0.45) MALT1TRPM4CFTR
SCHEMBL29971684 0.80 MALT1 (0.45) MALT1TRPM4CFTR
SCHEMBL20265550 0.73 PIN1 (0.35) MALT1ADORA2AADORA2BNPC1SMN1; SMN2
SCHEMBL24869524 0.72 MALT1 (0.51) MALT1NPC1
SCHEMBL20265085 0.70 PLAU (0.37) MALT1ADORA2AADORA2B
SCHEMBL20278394 0.70 HPGDS (0.33) MALT1ADORA2AADORA2BLRRK2
SCHEMBL23928410 0.69 MALT1 (0.58) MALT1
SCHEMBL24869563 0.67 MALT1 (0.32) MALT1

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-11230545-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-01-25 — — US disclosed
US-20210332045-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-10-28 — — 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-11230545-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D MALT1 1/4885ADORA2A 4808/4885ADORA2B 4885/4885
US-20210332045-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D MALT1 1/4885ADORA2A 4808/4885ADORA2B 4885/4885

“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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