SCHEMBL30440293

SCHEMBL30440293

CCc1ccc(-c2ccc3nccc(-c4ccccc4)c3c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 6/20 0.69
MAPKAPK2 P49137 4/20 0.67
CAMKK1 Q8N5S9 1/20 0.47
CAMKK2 Q96RR4 1/20 0.47
ACVR1 Q04771 4/20 0.45
MAP4K4 O95819 1/20 0.43
KDR P35968 1/20 0.42
AKT1 P31749 2/20 0.42
MAPT P10636 1/20 0.41
ALK Q9UM73 1/20 0.40

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
SCHEMBL30440162 0.90 PIK3CA (0.57) PIK3CAMAPKAPK2CAMKK1CAMKK2ACVR1
SCHEMBL9709110 0.88 PIK3CA (0.87) PIK3CAMAPKAPK2CAMKK1CAMKK2ACVR1
SCHEMBL30439681 0.81 PIK3CA (0.55) PIK3CAMAPKAPK2CAMKK1CAMKK2ACVR1
SCHEMBL30440085 0.79 PSMB5 (0.56) PIK3CAMAPKAPK2ACVR1AKT1MAPT
SCHEMBL30440201 0.78 PSMB5 (0.52) PIK3CAMAPKAPK2AKT1
SCHEMBL30439475 0.78 PIK3CA (0.57) PIK3CAMAPKAPK2CAMKK1CAMKK2ACVR1
SCHEMBL29903866 0.77 PSMB5 (0.51) PIK3CAMAPKAPK2
SCHEMBL29903844 0.77 PSMB5 (0.51) PIK3CAMAPKAPK2
SCHEMBL29903858 0.77 PSMB5 (0.51) PIK3CAMAPKAPK2
SCHEMBL19009538 0.77 MAPKAPK2 (0.47) PIK3CAMAPKAPK2CAMKK1CAMKK2ACVR1

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-20230183179-A1 NOVEL CELL METABOLISM MODULATING COMPOUNDS AND USES THEREOF CRESCENTA BIOSCIENCES (US) 2023-06-15 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-20230183179-A1 NOVEL CELL METABOLISM MODULATING COMPOUNDS AND USES THEREOF FABP4, FABP1, FABP3 PIK3CA 3770/4885MAPKAPK2 1122/4885CAMKK1 1364/4885

“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.