SCHEMBL4243209

SCHEMBL4243209

COC(=O)C1=C(O)C(CC2CCCCC2)CNC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.34
KMT2A Q03164 2/20 0.34
P4HB P07237 1/20 0.34
NAAA Q02083 7/20 0.33
HSD17B10 Q99714 3/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPT P10636 2/20 0.33
ASAH1 Q13510 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
HPGD P15428 1/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GLA P06280 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL4242937 0.83 KMT2A (0.36) KMT2AP4HBNAAAMAPTASAH1
SCHEMBL4248362 0.78 ALDH1A1 (0.34) ALDH1A1KMT2ANAAAHSD17B10KDM4E
SCHEMBL13743332 0.72 RXFP1 (0.44) KMT2AMAPTSMN1; SMN2
SCHEMBL13744066 0.68 ROCK1 (0.41) ALDH1A1KMT2AMAPTNPSR1
SCHEMBL28625179 0.67 MMP1 (0.32) ALDH1A1KMT2ANAAAHSD17B10KDM4E
SCHEMBL6684780 0.66 MAPT (0.40) KMT2AP4HBNAAAMAPTASAH1
SCHEMBL13602082 0.65 PARP1 (0.38) ALDH1A1KMT2AHSD17B10KDM4EMAPT
SCHEMBL28560703 0.62 KDM4E (0.43) KDM4E
SCHEMBL13598159 0.62 PARP1 (0.35) ALDH1A1KMT2AKDM4EMAPTTDP1
SCHEMBL1003669 0.62 ALDH1A1 (0.36) ALDH1A1KMT2AHSD17B10KDM4EMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 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-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE FDPS, UMPS, GGPS1 ALDH1A1 3119/4885KMT2A 4780/4885P4HB 514/4885

“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.