SCHEMBL3344524

SCHEMBL3344524

Cn1c[c]cc(C(=O)O)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
NR4A1 P22736 1/20 0.35
RECQL P46063 1/20 0.35
ESR2 Q92731 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NOTUM Q6P988 1/20 0.34
BCAT2 O15382 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 2/20 0.31
RAB9A P51151 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP1A2 P05177 1/20 0.31
BRD4 O60885 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL3348514 0.77 KDM4E (0.38) KMT2AMEN1TDP1LMNAHPGD
SCHEMBL3451768 0.76 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL8832354 0.71
SCHEMBL3348287 0.69 CNR2 (0.43) KMT2AMAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL955837 0.69
SCHEMBL5250090 0.67
SCHEMBL2280624 0.67 ALDH1A1 (0.46) POLBMAPTNR4A1TDP1NOTUM
Hydrochloric Acid SCHEMBL17597430 0.65 ALDH1A1 (0.44) POLBMAPTNR4A1TDP1NOTUM
SCHEMBL783327 0.65 CHEK1 (0.39) KMT2AMEN1MAPTTDP1NOTUM
SCHEMBL20326799 0.65 MEN1 (0.43) KMT2AMEN1NOTUMHPGDALDH1A1

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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD KMT2A 4408/4885MEN1 859/4885POLB 1098/4885

“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.