SCHEMBL21856499

SCHEMBL21856499

CC1CCc2ccc(CCCCC(F)C3CCNC3)nc2N1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.42
ITGAV P06756 17/20 0.39
ITGB6 P18564 6/20 0.39
ITGB3 P05106 11/20 0.35
ITGB8 P26012 2/20 0.33

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
SCHEMBL21856498 1.00 PDE10A (0.42) PDE10AITGAVITGB6ITGB3ITGB8
SCHEMBL25907344 0.89 PDE10A (0.43) PDE10AITGAVITGB6ITGB3
SCHEMBL21777742 0.83 ITGAV (0.55) ITGAVITGB6ITGB3ITGB8
SCHEMBL21777740 0.83 ITGAV (0.55) ITGAVITGB6ITGB3ITGB8
Hydrochloric Acid SCHEMBL21777913 0.82 ITGAV (0.54) ITGAVITGB6ITGB3ITGB8
Hydrochloric Acid SCHEMBL21856566 0.82 ITGAV (0.54) ITGAVITGB6ITGB3ITGB8
Hydrochloric Acid SCHEMBL21856568 0.82 ITGAV (0.54) ITGAVITGB6ITGB3ITGB8
Hydrochloric Acid SCHEMBL21777908 0.82 ITGAV (0.54) ITGAVITGB6ITGB3ITGB8
SCHEMBL21767452 0.78 PDE10A (0.44) PDE10AITGAVITGB6
SCHEMBL21767449 0.78 PDE10A (0.44) PDE10AITGAVITGB6

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-12528803-B2 Inhibitors of αvβ6 integrin MORPHIC THERAPEUTIC, INC. (US) 2026-01-20 US disclosed
EP-3844162-B1 INHIBITORS OF ALPHA V BETA6 INTEGRIN MORPHIC THERAPEUTIC INC (US) 2025-01-01 EP disclosed
US-20230242524-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-08-03 US disclosed
EP-3844162-A1 INHIBITORS OF av beta6 INTEGRIN Morphic Therapeutic, Inc. (US) 2021-07-07 EP disclosed
WO-2020081154-A1 INHIBITORS OF ανβ6 INTEGRIN MORPHIC THERAPEUTIC, INC. (US) 2020-04-23 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-20230242524-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV PDE10A 4466/4885ITGAV 3/4885ITGB6 1/4885
US-12528803-B2 Inhibitors of αvβ6 integrin ITGB2, ITGB6, ITGA2 PDE10A 3397/4885ITGAV 10/4885ITGB6 2/4885

“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.