SCHEMBL4094478

SCHEMBL4094478

NC(=O)c1cc(C(C(N)=O)[C@@H]2CCOC2)c2[nH]c3c(c2c1)CCCC3

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
HSD17B10 Q99714 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALOX15 P16050 2/20 0.42
MAPK1 P28482 2/20 0.42
TP53 P04637 2/20 0.42
IKBKB O14920 1/20 0.42
USP2 O75604 1/20 0.42
MAPK10 P53779 1/20 0.42
CASP1 P29466 3/20 0.38
CASP7 P55210 2/20 0.38
HTR1B P28222 3/20 0.38
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
F2 P00734 1/20 0.36
BTK Q06187 2/20 0.35
HTR1A P08908 2/20 0.35

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
SCHEMBL2021575 0.94 MAPT (0.43) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL4094487 0.74 SMN1; SMN2 (0.41) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL2021582 0.70 SMN1; SMN2 (0.45) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL2020896 0.67 HTR1B (0.44) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL2044381 0.66 HSD17B10 (0.47) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL2050348 0.65 HSD17B10 (0.46) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL2044387 0.65 HSD17B10 (0.46) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL29643283 0.64 F2 (0.74) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL6447738 0.64 F2 (0.74) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL2044383 0.62 KDM4E (0.51) MAPTHSD17B10ALDH1A1MEN1KMT2A

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-20090062251-A1 Novel Compounds 002 ASTRAZENECA AB (SE) 2009-03-05 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-20090062251-A1 Novel Compounds 002 OPRL1, OPRK1, OPRM1 MAPT 2916/4885HSD17B10 1777/4885ALDH1A1 517/4885

“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.