SCHEMBL13802421

SCHEMBL13802421

Cc1ccc(C(=O)n2cc(CC(=O)O)c3ccccc32)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
KDM4E B2RXH2 2/20 0.57
MEN1 O00255 1/20 0.57
ABCB1 P08183 3/20 0.56
AKR1C3 P42330 5/20 0.53
AKR1C2 P52895 3/20 0.53
PTGS2 P35354 2/20 0.53
PTGS1 P23219 2/20 0.53
AKR1C4 P17516 1/20 0.53
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51
CDC25A P30304 1/20 0.48
ALDH1A1 P00352 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL12286233 0.80 AKR1C3 (0.81) AKR1C3AKR1C2PTGS1AKR1C4
SCHEMBL13802419 0.80 AKR1C3 (0.58) KMT2AKDM4EMEN1ABCB1AKR1C3
SCHEMBL4216463 0.80 AKR1C3 (0.58) KMT2AABCB1AKR1C3AKR1C2PTGS2
SCHEMBL31432746 0.80 CDC25A (0.55) KDM4ELMNAMAPTHTTCDC25A
SCHEMBL13813995 0.80 KMT2A (0.66) KMT2AKDM4EMEN1PTGS2LMNA
SCHEMBL16072693 0.80 KMT2A (0.58) KMT2AKDM4EMEN1ABCB1PTGS2
SCHEMBL2467334 0.79 CDC25A (0.54) KDM4EAKR1C3AKR1C2LMNACDC25A
SCHEMBL28466412 0.78 KMT2A (0.61) KMT2AKDM4EMEN1AKR1C3AKR1C2
SCHEMBL27474952 0.78 AKR1C3 (0.59) KMT2AKDM4EABCB1AKR1C3AKR1C2
SCHEMBL9153676 0.78 AKR1C3 (0.50) KMT2AKDM4EABCB1AKR1C3AKR1C2

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-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 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-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD APP, PSEN2, PSEN1 KMT2A 2408/4885KDM4E 4461/4885MEN1 694/4885

“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.