SCHEMBL22843398

SCHEMBL22843398

CN(CP)S(=O)(=O)c1ccc(F)c(-c2cn(C3CC3)cn2)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GABRA2 P47869 8/20 0.37
▸ NLRP3 Q96P20 1/20 0.35
▸ MAOA P21397 4/20 0.33
▸ CASP3 P42574 3/20 0.33
▸ MAOB P27338 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ KDM2B Q8NHM5 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TRPV3 Q8NET8 1/20 0.32
▸ TSHR P16473 1/20 0.31

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
SCHEMBL22718094 0.83 CDK5 (0.43) MAOACASP3MAOBHTTALDH1A1
SCHEMBL22843386 0.83 TEAD1 (0.39) MAOACASP3MAOBHTTDPP4
SCHEMBL22843395 0.81 TRPV3 (0.36) GABRA2MAOACASP3MAOBHTT
SCHEMBL22843401 0.78 TEAD1 (0.39) —
SCHEMBL22843420 0.78 TEAD1 (0.41) KDM4EMAPT
SCHEMBL22843436 0.75 TEAD1 (0.40) KDM4EMAPT
SCHEMBL22843396 0.71 HTT (0.46) HTTKDM4EALDH1A1LMNAMAPT
SCHEMBL22843388 0.68 MAPT (0.41) MAOACASP3MAOBHTTKDM4E
SCHEMBL22843431 0.68 MAOA (0.36) MAOACASP3MAOBKDM4EALDH1A1
SCHEMBL27909939 0.67 KDM2B (0.41) KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760728-B2 Tead inhibitors and uses thereof Ikena Oncology, Inc. (US) 2023-09-19 — — US disclosed
US-11274082-B2 Tead inhibitors and uses thereof Ikena Oncology, Inc. (US) 2022-03-15 — — US disclosed
US-20200407327-A1 TEAD INHIBITORS AND USES THEREOF THE EHE FOUNDATION 2020-12-31 — — 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 (3 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-11274082-B2 Tead inhibitors and uses thereof TEAD2, TEAD3, TEAD4 GABRA2 4220/4885NLRP3 270/4885MAOA 1322/4885
US-11760728-B2 Tead inhibitors and uses thereof TEAD2, TEAD3, TEAD4 GABRA2 4220/4885NLRP3 270/4885MAOA 1322/4885
US-20200407327-A1 TEAD INHIBITORS AND USES THEREOF TEAD2, TEAD3, TEAD4 GABRA2 4220/4885NLRP3 270/4885MAOA 1322/4885

“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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