SCHEMBL34461817

SCHEMBL34461817

CC1(C)OB(c2ccc(F)c(CN3CCCC3)c2)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
ROCK1 Q13464 1/20 0.44
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LPL P06858 9/20 0.41
LIPG Q9Y5X9 9/20 0.41
HTT P42858 1/20 0.40
CYP2A13 Q16696 1/20 0.36
MTNR1B P49286 2/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL19211744 0.89 KDM4E (0.52) ALDH1A1ROCK1KDM4ESMN1; SMN2LPL
SCHEMBL21644162 0.88 KDM4E (0.55) ALDH1A1ROCK1KDM4ESMN1; SMN2LPL
SCHEMBL17427861 0.82 KDM4E (0.54) ALDH1A1KDM4E
SCHEMBL16023943 0.79 SCN9A (0.46) ALDH1A1ROCK1KDM4ESMN1; SMN2LPL
SCHEMBL18579955 0.79 ROCK1 (0.53) ALDH1A1ROCK1KDM4ESMN1; SMN2LPL
SCHEMBL428922 0.79 CYP2A13 (0.50) ALDH1A1ROCK1KDM4ESMN1; SMN2LPL
SCHEMBL27160039 0.79 MGLL (0.39) ROCK1SMN1; SMN2LPLLIPGCYP2A13
SCHEMBL29914778 0.79 MGLL (0.39) ROCK1SMN1; SMN2LPLLIPGCYP2A13
SCHEMBL18580183 0.78 ROCK1 (0.45) ALDH1A1ROCK1KDM4ESMN1; SMN2
SCHEMBL15573562 0.78 LPL (0.49) ROCK1LPLLIPGEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260098044-A1 TRICYCLIC HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2 AND/OR JAK1 INCYTE CORP (US) 2026-04-09 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 (1 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-20260098044-A1 TRICYCLIC HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2 AND/OR JAK1 JAK1, TYK2, JAK2 ALDH1A1 1336/4885ROCK1 77/4885KDM4E 1764/4885

“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.