SCHEMBL25567977

SCHEMBL25567977

CC(C)CCN1CC[C@H](NC(=O)NC(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.43
EPHX1 P07099 3/20 0.41
PARP1 P09874 2/20 0.40
EPHX2 P34913 3/20 0.39
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
FPR3 P25089 1/20 0.38
FPR2 P25090 1/20 0.38
CYP2D6 P10635 2/20 0.37
CACNA1H O95180 1/20 0.37
KCNH2 Q12809 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
CYP2C9 P11712 1/20 0.37
HTR7 P34969 1/20 0.36

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
SCHEMBL25567971 1.00 KDM5A (0.43) KDM5AEPHX1PARP1EPHX2GLA
SCHEMBL25568006 0.93 EPHX1 (0.45) KDM5AEPHX1PARP1EPHX2GLA
SCHEMBL25570021 0.88 EPHX2 (0.48) KDM5AEPHX1EPHX2HPGDSMN1; SMN2
SCHEMBL17485873 0.85 KDM5A (0.41) KDM5AEPHX1EPHX2GLAHPGD
SCHEMBL25579419 0.83 LTA4H (0.48) KDM5APARP1ALDH1A1FPR3FPR2
SCHEMBL28249224 0.83 LTA4H (0.40) PARP1FPR3FPR2HTR7
SCHEMBL6961934 0.83 LTA4H (0.48) KDM5APARP1ALDH1A1FPR3FPR2
SCHEMBL12443040 0.83 LTA4H (0.48) KDM5APARP1ALDH1A1FPR3FPR2
SCHEMBL25567982 0.82 ALDH1A1 (0.44) PARP1GLAALDH1A1FPR3FPR2
SCHEMBL25567976 0.82 ALDH1A1 (0.44) PARP1GLAALDH1A1FPR3FPR2

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-20230167105-A1 BCL-2 PROTEIN INHIBITORS RECURIUM IP HOLDINGS, LLC 2023-06-01 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-20230167105-A1 BCL-2 PROTEIN INHIBITORS BCL2, BCL2L1, BCL2L2 KDM5A 3541/4885EPHX1 4433/4885PARP1 518/4885

“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.