SCHEMBL5450799

SCHEMBL5450799

NC(=O)c1c(NC(=O)NC2CCCCC2)sc2cc(O)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.49
TP53 P04637 1/20 0.47
MAOB P27338 2/20 0.46
EPHX2 P34913 5/20 0.43
RAB9A P51151 6/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
GAA P10253 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
ESR1 P03372 1/20 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
SCHEMBL5447612 0.99 EPHX1 (0.47) EPHX1TP53MAOBEPHX2RAB9A
SCHEMBL5457824 0.94 RAB9A (0.43) EPHX1TP53MAOBEPHX2RAB9A
SCHEMBL5458996 0.89 RAB9A (0.43) EPHX1TP53MAOBRAB9ANPC1
SCHEMBL5451289 0.81 EPHX2 (0.44) EPHX1EPHX2RAB9ANPC1SMN1; SMN2
SCHEMBL5450964 0.80 FLT3 (0.48) MAOBHTTESR1
SCHEMBL5455562 0.80 ESR1 (0.41) TP53ALDH1A1CYP2C9CYP2C19MEN1
SCHEMBL5460519 0.76 ESR1 (0.39) CYP2C9CYP2C19HTTTSHRESR1
SCHEMBL5451109 0.76 MEN1 (0.56) EPHX1TP53MAOBEPHX2RAB9A
SCHEMBL5462756 0.75 ESR1 (0.39) RAB9ANPC1ALDH1A1GAAMEN1
SCHEMBL5467623 0.75 KDR (0.42) RAB9ANPC1ALDH1A1GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US claimed
EP-1670804-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC Biotech AG (DE) 2006-06-21 EP claimed
WO-2005023818-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC BIOTECH AG (DE) 2005-03-17 WO claimed
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 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-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents TBCA, PARK7, NFATC1 EPHX1 4160/4885TP53 2520/4885MAOB 182/4885

“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.