SCHEMBL5118637

SCHEMBL5118637

O=C(O)c1cnc(-c2ccccc2)nc1Oc1ccccc1F

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.69
MEN1 O00255 7/20 0.69
TDP1 Q9NUW8 1/20 0.62
CYP1A2 P05177 5/20 0.53
CYP2C9 P11712 3/20 0.53
CYP2C19 P33261 3/20 0.53
POLB P06746 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 5/20 0.49
LMNA P02545 3/20 0.49
HPGD P15428 1/20 0.48
MAPT P10636 4/20 0.47
MAPK1 P28482 2/20 0.47
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ATM Q13315 1/20 0.45
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL14099386 0.90 KMT2A (0.63) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5126068 0.85 KMT2A (0.71) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5126454 0.84 KMT2A (0.69) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5111594 0.84 KMT2A (0.69) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5117637 0.83 TDP1 (0.60) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5127183 0.82 KMT2A (0.67) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5115261 0.82 MEN1 (1.00) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5124890 0.81 KMT2A (0.64) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL5119125 0.81 TDP1 (0.65) KMT2AMEN1TDP1CYP1A2CYP2C9
SCHEMBL29050110 0.80 KMT2A (0.71) KMT2AMEN1TDP1CYP1A2CYP2C9

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-20080194598-A1 Pyrimidine Carboxylic Acid Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2008-08-14 US disclosed
US-20080194598-A1 Pyrimidine Carboxylic Acid Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2008-08-14 US disclosed
US-20080194598-A1 Pyrimidine Carboxylic Acid Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2008-08-14 US disclosed
CN-101175731-A Pyrimidine carboxylic acid derivatives and uses thereof BAYER HEALTHCARE AG (DE) 2008-05-07 CN 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-20080194598-A1 Pyrimidine Carboxylic Acid Derivatives and Use Thereof DPYD, TYMP, TYMS KMT2A 3441/4885MEN1 4226/4885TDP1 273/4885

“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.