SCHEMBL21777237

SCHEMBL21777237

CC(=O)OCc1cc(F)cc(Br)c1CC1OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 2/20 0.32
CYP3A4 P08684 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CA2 P00918 1/20 0.31
KDM4E B2RXH2 2/20 0.30
HSD17B10 Q99714 2/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30

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
SCHEMBL1394359 0.75 CA2 (0.46) CYP3A4ALDH1A1CA2KDM4EHSD17B10
SCHEMBL21777461 0.74 MEN1 (0.37) CYP3A4ALDH1A1CA2KDM4EHSD17B10
SCHEMBL18778750 0.70 CA2 (0.41) CYP3A4ALDH1A1CA2KDM4EHSD17B10
SCHEMBL30881188 0.68 ALDH1A1 (0.41) CYP3A4ALDH1A1KDM4EHSD17B10
SCHEMBL14448981 0.68 ALDH1A1 (0.41) CYP3A4ALDH1A1KDM4EHSD17B10
SCHEMBL13034093 0.65 RIPK1 (0.46) CYP3A4ALDH1A1KDM4EHSD17B10CYP4F2
SCHEMBL25840103 0.62 MMP1 (0.49) CYP3A4ALDH1A1CA2KDM4EHSD17B10
SCHEMBL13034155 0.62 MMP2 (0.54) CYP3A4ALDH1A1KDM4EHSD17B10CYP4F2
SCHEMBL28788679 0.62 HSD17B10 (0.39) CYP3A4ALDH1A1CA2KDM4EHSD17B10
SCHEMBL19683552 0.61 ALDH1A1 (0.44) CYP3A4ALDH1A1CA2KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3843728-B1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC INC (US) 2025-04-30 EP disclosed
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US disclosed
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US disclosed
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US disclosed
EP-3843728-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN Morphic Therapeutic, Inc. (US) 2021-07-07 EP disclosed
WO-2020047207-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTICS, INC. (US) 2020-03-05 WO disclosed
WO-2020047207-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTICS, INC. (US) 2020-03-05 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 (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-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV GSTP1 3547/4885CYP3A4 3272/4885ALDH1A1 1534/4885

“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.