SCHEMBL635842

SCHEMBL635842

Cc1cccc2cc3c(=O)n(Cc4ccccn4)cc(C(=O)O)c3nc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.61
SLC22A12 Q96S37 1/20 0.43
BRD4 O60885 2/20 0.42
ALDH1A1 P00352 6/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
RAB9A P51151 1/20 0.41
CASP7 P55210 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
PDE10A Q9Y233 1/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
ADRA1D P25100 1/20 0.38
LMNA P02545 1/20 0.38
PIK3CD O00329 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
SCHEMBL634977 0.85 KDM4E (0.46) KDM4EBRD4ALDH1A1HPGDHSD17B10
SCHEMBL635320 0.83 KMT2A (0.44) KDM4EBRD4ALDH1A1HPGDHSD17B10
SCHEMBL634012 0.81 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL635404 0.79 PTGDR2 (0.39) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL634900 0.79 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL632020 0.79 CNR2 (0.39) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL634904 0.78 MAPK10 (0.44) KDM4EALDH1A1HPGDPDE10AMEN1
SCHEMBL634442 0.78 L3MBTL1 (0.43) KDM4EALDH1A1HSD17B10TSHRCASP1
SCHEMBL30122318 0.77 KDM4E (0.41) KDM4EBRD4ALDH1A1HPGDHSD17B10
SCHEMBL634087 0.77 KDM4E (0.41) KDM4EBRD4ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES BAGULEY BRUCE CHARLES 2009-06-18 US claimed
EP-1507778-B1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES UNIV TROBE (AU) 2012-02-22 EP disclosed
US-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES BAGULEY BRUCE CHARLES 2009-06-18 US disclosed
US-7504507-B2 Anti-tumour polycyclic carboxamides AUCKLAND UNISERVICES LIMITED (NZ) 2009-03-17 US disclosed
US-20050245561-A1 Anti-tumour polycyclic carboxamides AUCKLAND UNISERVICES LIMITED (NZ) 2005-11-03 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 (2 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-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES MKI67, MCL1, CCNI KDM4E 744/4885SLC22A12 2019/4885BRD4 191/4885
US-20050245561-A1 Anti-tumour polycyclic carboxamides MKI67, MCL1, CCNI KDM4E 880/4885SLC22A12 2062/4885BRD4 196/4885

“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.