SCHEMBL4246914

SCHEMBL4246914

O=C(Nc1ccc(Nc2ccccc2)cc1)C1=C(O)CC(C2CCCCC2)NC1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
GAA P10253 3/20 0.43
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
GFER P55789 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 1/20 0.40
BUB1 O43683 3/20 0.40
HTR1E P28566 1/20 0.39
S1PR3 Q99500 1/20 0.39
RAB9A P51151 3/20 0.39
EPHX2 P34913 2/20 0.39
EPHX1 P07099 1/20 0.39
CASP3 P42574 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
RET P07949 1/20 0.38
NPC1 O15118 2/20 0.38

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
SCHEMBL4246968 0.89 EPHX1 (0.48) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4250686 0.88 KMT2A (0.44) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4245288 0.86 DEGS1 (0.51) MAPTGAAMEN1KMT2AHPGD
SCHEMBL4244100 0.84 RXFP1 (0.47) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4237397 0.84 MAPT (0.46) MAPTGAAMEN1KMT2AGFER
SCHEMBL4246135 0.81 ALDH1A1 (0.52) MAPTGAAMEN1KMT2ASMN1; SMN2
SCHEMBL4244777 0.81 CHEK2 (0.39) KMT2A
SCHEMBL4246052 0.79 PORCN (0.41) KMT2A
SCHEMBL4243191 0.76 DEGS1 (0.50) MAPTMEN1KMT2AHPGDRAB9A
SCHEMBL4241902 0.76 DEGS1 (0.50) MAPTMEN1KMT2AHPGDRAB9A

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 MAPT 1345/4885GAA 632/4885MEN1 2345/4885

“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.