SCHEMBL5652071

SCHEMBL5652071

O=C(NCCCN1CCOCC1)c1sc2c(ccc(=O)n2-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
HIF1A Q16665 1/20 0.51
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 1/20 0.48
HPGD P15428 2/20 0.47
TP53 P04637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 3/20 0.46
GLA P06280 1/20 0.46
CD274 Q9NZQ7 1/20 0.45
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL5652540 0.95 HPGD (0.52) HTTKDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL5651076 0.90 BCL2L1 (0.47) HTTKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL2958448 0.88 ALDH1A1 (0.50) HTTHIF1AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5653732 0.86 PARP1 (0.47) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL5651037 0.85 PARP1 (0.46) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL5654415 0.84 HIF1A (0.38) HTTHIF1AKDM4EALDH1A1SMN1; SMN2
SCHEMBL2953745 0.82 LMNA (0.51) HTTKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL5652559 0.80 SMN1; SMN2 (0.52) HTTHIF1AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5652095 0.79 HPGD (0.45) HTTKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL5649437 0.79 HPGD (0.44) KDM4EALDH1A1SMN1; SMN2KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7176215-B2 Bicyclic oxopyridine and oxopyrimidine derivatives CELLTECH R&D LIMITED (GB) 2007-02-13 US disclosed
US-20040254200-A1 Bicyclic oxopyridine and oxopyrimidine derivatives UCB PHARMA S.A. (BE) 2004-12-16 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-20040254200-A1 Bicyclic oxopyridine and oxopyrimidine derivatives MAPK1, ALK, NAT1 HTT 3188/4885HIF1A 1212/4885KDM4E 3821/4885

“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.