SCHEMBL20688124

SCHEMBL20688124

CNc1cc(Cl)cn(-c2cnc(C(=O)N(C)C)cn2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 2/20 0.42
▸ PARP1 P09874 1/20 0.33
▸ MALT1 Q9UDY8 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TTK P33981 1/20 0.31
▸ LRRK2 Q5S007 3/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ KAT2B Q92831 1/20 0.30
▸ BRD9 Q9H8M2 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
SCHEMBL20696763 0.89 TYK2 (0.41) TYK2PARP1KAT2B
SCHEMBL20689216 0.83 TYK2 (0.42) TYK2PARP1MALT1KDM4ESMN1; SMN2
SCHEMBL16812533 0.73 TYK2 (0.56) TYK2PARP1KDM4ESMN1; SMN2
SCHEMBL21227386 0.70 TYK2 (0.55) TYK2KDM4E
SCHEMBL20688025 0.66 TYK2 (0.38) TYK2SMN1; SMN2KAT2BBRD9
SCHEMBL20687635 0.66 TYK2 (0.38) TYK2KDM4ESMN1; SMN2KAT2BBRD9
SCHEMBL20688221 0.66 KAT2B (0.38) TYK2SMN1; SMN2KAT2BBRD9
SCHEMBL16812418 0.66 TYK2 (0.54) TYK2PARP1KDM4E
SCHEMBL22252591 0.65 KAT2B (0.43) TYK2SMN1; SMN2KAT2BBRD9
SCHEMBL22272968 0.65 TYK2 (0.51) TYK2SMN1; SMN2KAT2BBRD9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020154474-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2020-07-30 — — WO disclosed
US-10562907-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 — — US disclosed
US-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-15 — — US disclosed
WO-2019023468-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2019-01-31 — — WO 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-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TYK2 1/4885PARP1 939/4885MALT1 636/4885
US-10562907-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TYK2 1/4885PARP1 939/4885MALT1 636/4885

“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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