SCHEMBL22252304

SCHEMBL22252304

CO[C@H]1CCN(c2cc(NS)cc(C)n2)C1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 3/20 0.51
▸ HRH4 Q9H3N8 1/20 0.40
▸ P2RY12 Q9H244 1/20 0.36
▸ MAP3K12 Q12852 2/20 0.36
▸ NAPEPLD Q6IQ20 1/20 0.36
▸ ACACB O00763 4/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ ABCG2 Q9UNQ0 1/20 0.34
▸ PRKAB2 O43741 2/20 0.34
▸ PRKAG1 P54619 2/20 0.34
▸ PRKAA2 P54646 2/20 0.34
▸ PRKAA1 Q13131 2/20 0.34
▸ PRKAG3 Q9UGI9 2/20 0.34
▸ PRKAG2 Q9UGJ0 2/20 0.34
▸ PRKAB1 Q9Y478 2/20 0.34
▸ PTGER4 P35408 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
SCHEMBL22272972 0.88 TYK2 (0.55) TYK2HRH4P2RY12MAP3K12NAPEPLD
SCHEMBL25069778 0.85 TYK2 (0.49) TYK2HRH4P2RY12MAP3K12NAPEPLD
SCHEMBL20697164 0.85 TYK2 (0.49) TYK2HRH4P2RY12MAP3K12ACACB
SCHEMBL23583130 0.82 TYK2 (0.47) TYK2HRH4P2RY12MAP3K12ACACB
SCHEMBL20689537 0.80 TYK2 (0.48) TYK2HRH4MAP3K12ACACBMAP4K4
SCHEMBL20697366 0.74 TYK2 (0.45) TYK2HRH4MAP3K12NAPEPLDLRRK2
SCHEMBL24370192 0.73 PIK3CD (0.45) TYK2HRH4MAP3K12ACACBMAP4K4
SCHEMBL24370196 0.73 PIK3CD (0.45) TYK2HRH4MAP3K12ACACBMAP4K4
SCHEMBL12494898 0.73 PIK3CD (0.45) TYK2HRH4MAP3K12ACACBMAP4K4
SCHEMBL20688035 0.69 TYK2 (0.54) TYK2HRH4

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-11174264-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-11-16 — — US disclosed
US-20200231594-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-07-23 — — 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-11174264-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TYK2 1/4885HRH4 2233/4885P2RY12 3554/4885
US-20200231594-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TYK2 1/4885HRH4 2233/4885P2RY12 3554/4885

“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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