SCHEMBL6762845

SCHEMBL6762845

CCCCCC(=O)Oc1cc(C(=O)O)cc(OC(=O)CCCCC)c1OC(=O)CCCCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
ALOX15 P16050 1/20 0.49
PLA2G2A P14555 1/20 0.46
POLM Q9NP87 1/20 0.43
POLK Q9UBT6 1/20 0.43
POLL Q9UGP5 1/20 0.43
POLH Q9Y253 1/20 0.43
TOP2A P11388 2/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1B1 P15121 1/20 0.41
LMNA P02545 2/20 0.41
PAM P19021 2/20 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
SCHEMBL16389120 0.98 KDM4E (0.49) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL1108082 0.98 KDM4E (0.49) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL6759814 0.98 KDM4E (0.49) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL6763903 0.95 KMT2A (0.55) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL3607900 0.89 ALOX15 (0.45) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL31454171 0.88 ALDH1A1 (0.52) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL18078285 0.86 ALOX15 (0.48) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL6766240 0.85 ALOX15 (0.47) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL16671445 0.85 POLB (0.54) KDM4EMEN1RECQLKMT2AALOX15
SCHEMBL6761527 0.84 ALOX15 (0.46) KDM4EMEN1RECQLKMT2AALOX15

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-20040247698-A1 Erectile Dysfunction Treatment VALENZUELA CORTES CARMEN MARIA (CL) 2004-12-09 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-20040247698-A1 Erectile Dysfunction Treatment PDE3A, PDE3B, PDE12 KDM4E 697/4885MEN1 3117/4885RECQL 1196/4885

“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.