SCHEMBL30701438

SCHEMBL30701438

O=C1Nc2cc(Cl)ccc2C12CCC2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.58
TNKS O95271 1/20 0.53
TNKS2 Q9H2K2 1/20 0.53
PDE7A Q13946 2/20 0.53
CMA1 P23946 1/20 0.46
AHR P35869 1/20 0.46
PKM P14618 1/20 0.46
MAPK14 Q16539 5/20 0.44
TP53 P04637 1/20 0.43
MDM2 Q00987 1/20 0.43
HTR1A P08908 2/20 0.43
HTR2A P28223 2/20 0.43
HTR7 P34969 2/20 0.43
HTR6 P50406 2/20 0.43
AKR1B1 P15121 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
PDE3B Q13370 1/20 0.42

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
SCHEMBL30701457 0.97 PGR (0.58) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL11641780 0.97 PGR (0.58) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL4715820 0.95 PGR (0.59) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL26666490 0.93 PGR (0.56) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL20955697 0.87 PKM (0.53) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL8220948 0.87 TNKS (0.51) PGRTNKSTNKS2PDE7ACMA1
SCHEMBL11641485 0.83 PGR (0.71) PGRPDE7APDE4APDE4BPDE4C
SCHEMBL5482190 0.81 PGR (0.72) PGRPDE7APDE4APDE4BPDE4C
SCHEMBL12782405 0.81 MAPK14 (0.50) PGRMAPK14AKR1B1PDE4APDE4B
SCHEMBL29621846 0.81 MAPK14 (0.50) PGRMAPK14AKR1B1PDE4APDE4B

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-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy ASTEX THERAPEUTICS LIMITED (GB) 2024-01-09 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-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 PGR 459/4885TNKS 1158/4885TNKS2 1891/4885

“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.