SCHEMBL634980

SCHEMBL634980

O=C(O)Cc1nc2ccccc2nc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
MAPT P10636 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
KDM4E B2RXH2 3/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
PIM1 P11309 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.43
AKR1B1 P15121 1/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.41
DYRK1A Q13627 1/20 0.41
LMNA P02545 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
SCHEMBL8079175 0.81 ALDH1A1 (0.64) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL11166760 0.80 ALDH1A1 (0.62) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL29860539 0.80 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL351486 0.80 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL28033468 0.78 SMN1; SMN2 (0.54) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL28384025 0.78 ALDH1A1 (0.95) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL4583699 0.74 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL634174 0.74 KDM4E (0.58) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL30301321 0.74 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL2805901 0.73 LMNA (0.62) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1

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
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

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-20090156630-A1 ANTI-TUMOUR POLYCYCLIC CARBOXAMIDES MKI67, MCL1, CCNI ALDH1A1 657/4885MAPT 4168/4885SMN1; SMN2 2755/4885

“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.