SCHEMBL26296337

SCHEMBL26296337

Cc1cnn(C2CCCCO2)c1B1OCC(C)(C)O1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
GAA P10253 1/20 0.32
ATR Q13535 1/20 0.32
RET P07949 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15388527 0.86 CYP4F2 (0.41) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL29048976 0.83 ALDH1A1 (0.43) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL24142066 0.78 CYP4F2 (0.41) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL19523845 0.78 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL24456419 0.75 KDM5B (0.36) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL3401227 0.74 ALDH1A1 (0.39) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL16132481 0.73 CYP4F2 (0.49) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL26986555 0.73 ALDH1A1 (0.39) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL24497787 0.72 CYP4F2 (0.48) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL19277096 0.71 ALDH1A1 (0.37) CYP4F2CYP4A11ALDH1A1LMNAPOLB

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-20230295166-A1 ATR INHIBITORS AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-09-21 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-20230295166-A1 ATR INHIBITORS AND USES THEREOF ATR, CHEK1, CHEK2 CYP4F2 4245/4885CYP4A11 4459/4885ALDH1A1 4462/4885

“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.