SCHEMBL29324958

SCHEMBL29324958

CC(C)C1CCC(=O)Nc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 7/20 0.45
CRBN Q96SW2 7/20 0.45
NPC1 O15118 1/20 0.43
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.41
BRD4 O60885 7/20 0.39
CREBBP Q92793 6/20 0.39
EP300 Q09472 1/20 0.39
OPRM1 P35372 2/20 0.38
OPRL1 P41146 1/20 0.38
AHR P35869 1/20 0.37
PDK2 Q15119 1/20 0.37
CHRM2 P08172 1/20 0.36
IKZF3 Q9UKT9 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
SCHEMBL10309642 0.83 ALDH1A1 (0.53) ALDH1A1BRD4CREBBPEP300
SCHEMBL8402252 0.80 MMP12 (0.41) DDB1CRBNALDH1A1BRD4CREBBP
SCHEMBL1347194 0.78 DDB1 (0.49) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL9278082 0.78 ALDH1A1 (0.38) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL9405618 0.75 NPC1 (0.47) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL9405619 0.75 NPC1 (0.47) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL8524142 0.74 CRBN (0.46) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL29960465 0.74 CRBN (0.40) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL8921290 0.73 MAPT (0.44) DDB1CRBNNPC1MAPK13MAPK12
SCHEMBL24090522 0.73 AR (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF ASIA VISION LIMITED (CN) 2024-07-18 US disclosed
US-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF ASIA VISION LIMITED (CN) 2024-07-18 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-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF BCL2, BCL2L2, BCL2L1 DDB1 979/4885CRBN 854/4885NPC1 3143/4885

“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.