SCHEMBL24759396

SCHEMBL24759396

Cc1cc(C(C)C)n(C)c(=O)c1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
LDHA P00338 1/20 0.33
LDHB P07195 1/20 0.33
BRD4 O60885 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALB P02768 1/20 0.30
KDM5B Q9UGL1 1/20 0.30
NOX4 Q9NPH5 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
SCHEMBL22016779 0.82 KDM4E (0.40) LMNAADORA3KDM4EALDH1A1GLA
SCHEMBL25606083 0.76 LMNA (0.33) LMNAADORA3
SCHEMBL14884309 0.72
SCHEMBL21146698 0.70
SCHEMBL21937407 0.69 NOX4 (0.42) LMNAADORA3LDHALDHBKDM4E
SCHEMBL24070512 0.68 NQO2 (0.39) LMNAADORA3KDM4EALDH1A1NOX4
SCHEMBL20280294 0.68 CRHR1 (0.38) LMNAADORA3KDM4EALDH1A1GLA
SCHEMBL13827862 0.67 PLA2G7 (0.34) LMNAADORA3KDM4EALDH1A1SMN1; SMN2
SCHEMBL21921254 0.67 ATAD2 (0.36) LMNAADORA3KDM4EALDH1A1GLA
SCHEMBL16831212 0.65

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-11680056-B2 MK2 inhibitors and uses thereof XINTHERA, INC. (US) 2023-06-20 US disclosed
US-20220402892-A1 MK2 INHIBITORS AND USES THEREOF XINTHERA, INC. 2022-12-22 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 (2 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-11680056-B2 MK2 inhibitors and uses thereof MKNK2, ENPP2, MAPKAPK2 LMNA 4348/4885ADORA3 4868/4885LDHA 4257/4885
US-20220402892-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, ENPP2, MAPKAPK2 LMNA 4260/4885ADORA3 4859/4885LDHA 4319/4885

“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.