SCHEMBL23928432

SCHEMBL23928432

NC(=O)Nc1cnc(-c2ncco2)c(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 1/20 0.44
▸ MALT1 Q9UDY8 6/20 0.41
▸ NTRK1 P04629 1/20 0.39
▸ NR3C2 P08235 4/20 0.37
▸ S1PR1 P21453 1/20 0.37
▸ S1PR3 Q99500 1/20 0.37
▸ ADORA2A P29274 2/20 0.35
▸ ADORA2B P29275 2/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ DHODH Q02127 1/20 0.34
▸ KIF11 P52732 1/20 0.34
▸ AR P10275 1/20 0.34

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
SCHEMBL23928440 0.81 MALT1 (0.46) CFTRMALT1NR3C2ADORA2AADORA2B
SCHEMBL25258265 0.76 CFTR (0.42) CFTRNTRK1SMN1; SMN2
SCHEMBL23928409 0.71 MALT1 (0.50) MALT1
SCHEMBL30595625 0.71 MALT1 (0.50) MALT1
SCHEMBL25302088 0.70 ALDH1A1 (0.50) CFTRNTRK1AR
SCHEMBL31038423 0.70 ALDH1A1 (0.50) CFTRNTRK1AR
SCHEMBL31348095 0.69 SMN1; SMN2 (0.48) CFTRS1PR1SMN1; SMN2KIF11AR
SCHEMBL20265568 0.69 MALT1 (0.47) MALT1NTRK1ADORA2AADORA2BADORA3
SCHEMBL2372212 0.68 CFTR (0.65) CFTRNTRK1
SCHEMBL31348089 0.68 MALT1 (0.52) MALT1NR3C2SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250034141-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-01-30 — — US disclosed
US-12152027-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-11-26 — — US disclosed
US-20220048916-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-02-17 — — US disclosed
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
CN-113038948-A Heterocyclic compounds 武田药品工业株式会社 2021-06-25 — — CN 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 (5 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-20250034141-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D CFTR 2389/4885MALT1 1/4885NTRK1 4511/4885
US-11230545-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D CFTR 2389/4885MALT1 1/4885NTRK1 4511/4885
US-20210332045-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D CFTR 2389/4885MALT1 1/4885NTRK1 4511/4885
US-12152027-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D CFTR 2389/4885MALT1 1/4885NTRK1 4511/4885
US-20220048916-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D CFTR 2389/4885MALT1 1/4885NTRK1 4511/4885

“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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