SCHEMBL21285403

SCHEMBL21285403

Cc1ccc(N)c(OC2CCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 4/20 0.39
▸ FFAR2 O15552 3/20 0.38
▸ MCHR1 Q99705 3/20 0.35
▸ JAK3 P52333 2/20 0.35
▸ HRH4 Q9H3N8 1/20 0.34
▸ PARP10 Q53GL7 1/20 0.33
▸ MBOAT4 Q96T53 1/20 0.33
▸ MAP3K12 Q12852 1/20 0.32
▸ CNR2 P34972 1/20 0.32

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
SCHEMBL8740731 0.85 RAF1 (0.44) LRRK2
SCHEMBL22105416 0.79 LRRK2 (0.39) LRRK2FFAR2HRH4
SCHEMBL19510827 0.79 MCHR1 (0.38) LRRK2FFAR2MCHR1JAK3HRH4
SCHEMBL15831972 0.79 MBOAT4 (0.38) LRRK2FFAR2JAK3HRH4MBOAT4
SCHEMBL25510477 0.77 LRRK2 (0.38) LRRK2FFAR2JAK3HRH4
SCHEMBL16334172 0.76 LRRK2 (0.39) LRRK2FFAR2JAK3HRH4MBOAT4
SCHEMBL15831963 0.76 LOX (0.39) LRRK2FFAR2MCHR1JAK3HRH4
SCHEMBL15831922 0.76 HRH4 (0.40) LRRK2HRH4MBOAT4CNR2
SCHEMBL6607678 0.75 FFAR4 (0.43) —
SCHEMBL15831965 0.74 LOX (0.41) LRRK2FFAR2MCHR1JAK3HRH4

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-10577373-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-03-03 — — US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 — — 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-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LRRK2 269/4885FFAR2 3861/4885MCHR1 3186/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LRRK2 269/4885FFAR2 3861/4885MCHR1 3186/4885

“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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