SCHEMBL21245951

SCHEMBL21245951

CC(C)Nc1cccc(N2CCO[C@]3(CCOC3)C2)n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 1/20 0.42
▸ KIF18A Q8NI77 9/20 0.35
▸ ACACB O00763 1/20 0.33
▸ ELOVL1 Q9BW60 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ CLK2 P49760 1/20 0.32
▸ GSK3A P49840 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ CSNK2A1 P68400 1/20 0.32
▸ STK3 Q13188 1/20 0.32
▸ HIPK4 Q8NE63 1/20 0.32
▸ CLK4 Q9HAZ1 1/20 0.32
▸ TYK2 P29597 3/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ SDHA P31040 1/20 0.32
▸ TRPV3 Q8NET8 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
SCHEMBL20696784 1.00 SOS1 (0.42) SOS1KIF18AACACBELOVL1SYK
SCHEMBL21245952 1.00 SOS1 (0.42) SOS1KIF18AACACBELOVL1SYK
SCHEMBL20688189 0.87 SOS1 (0.39) SOS1KIF18AACACBELOVL1SYK
SCHEMBL20688222 0.87 SOS1 (0.39) SOS1KIF18AACACBELOVL1SYK
SCHEMBL21285288 0.84 SOS1 (0.37) SOS1KIF18AACACBELOVL1SYK
SCHEMBL20688212 0.84 SOS1 (0.37) SOS1KIF18AACACBELOVL1SYK
SCHEMBL20697004 0.83 TYK2 (0.41) KIF18AACACBTYK2TRPV3
SCHEMBL20689076 0.79 GRIN2D (0.40) SOS1KIF18AELOVL1PTGS1SDHA
SCHEMBL13034794 0.78 GAA (0.44) KIF18AACACBCLK2GSK3AGSK3B
SCHEMBL21245954 0.78 TYK2 (0.46) KIF18ATYK2TRPV3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-23 — — US disclosed
US-10577373-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-03-03 — — US disclosed
US-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 — — US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 — — US disclosed
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 — — 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 (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-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 SOS1 1189/4885KIF18A 1817/4885ACACB 2158/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 SOS1 1189/4885KIF18A 1817/4885ACACB 2158/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 SOS1 1189/4885KIF18A 1817/4885ACACB 2158/4885
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 SOS1 1189/4885KIF18A 1817/4885ACACB 2158/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 SOS1 1189/4885KIF18A 1817/4885ACACB 2158/4885

“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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