SCHEMBL23792790

SCHEMBL23792790

CC1(C)OB(c2ccc3c(c2)c(-c2cnco2)nn3C2CCCCO2)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.34
▸ CYP4A11 Q02928 2/20 0.34
▸ DGAT2 Q96PD7 1/20 0.33
▸ ATR Q13535 4/20 0.31
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ RXRG P48443 1/20 0.31
▸ PRMT5 O14744 1/20 0.30
▸ WDR77 Q9BQA1 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
SCHEMBL31089969 0.81 GAA (0.36) CYP4F2CYP4A11DGAT2ATRRXRA
SCHEMBL20765180 0.81 GAA (0.36) CYP4F2CYP4A11DGAT2ATRRXRA
SCHEMBL20786559 0.81 CYP4F2 (0.39) CYP4F2CYP4A11DGAT2ATR
SCHEMBL23782723 0.81 CYP4F2 (0.43) CYP4F2CYP4A11DGAT2ATRRXRA
SCHEMBL25171411 0.81 CYP4F2 (0.36) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL29168077 0.81 IDO1 (0.35) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL20786488 0.79 ATR (0.39) CYP4F2CYP4A11DGAT2ATR
SCHEMBL20786309 0.79 MAPK1 (0.36) CYP4F2CYP4A11DGAT2ATR
SCHEMBL6508680 0.79 RET (0.32) CYP4F2CYP4A11DGAT2ATRRXRA
SCHEMBL30124206 0.79 RET (0.32) CYP4F2CYP4A11DGAT2ATRRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 — — US disclosed
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 — — US disclosed
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 — — US disclosed
WO-2021178780-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. (US) 2021-09-10 — — 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-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 CYP4F2 3449/4885CYP4A11 3829/4885DGAT2 1969/4885

“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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