SCHEMBL6465828

SCHEMBL6465828

NC(=O)c1nn(-c2ccc(Br)c(C(F)(F)F)c2)c(C(=O)O)c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.45
KMT2A Q03164 4/20 0.36
LMNA P02545 3/20 0.36
MEN1 O00255 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36
MAPT P10636 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SCN9A Q15858 7/20 0.35
POLB P06746 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34

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
SCHEMBL6470262 0.84 KMT2A (0.36) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL6470216 0.84 ALDH1A1 (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL6470677 0.76 HSD17B10 (0.43) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL6469850 0.75 ALKBH5 (0.42) ALKBH5KMT2ALMNAMEN1MAPT
SCHEMBL6470586 0.72 RPA1 (0.39) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL6467341 0.69 ITK (0.40) ALKBH5KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL6469689 0.69 ALDH1A1 (0.56) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL6470127 0.66 PARP1 (0.38) ALKBH5KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL1198272 0.66 MAPT (0.54) ALKBH5KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL10829840 0.64 PTGS2 (0.58) ALKBH5KMT2ALMNAMEN1SMN1; SMN2

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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 US disclosed
WO-2005037797-A1 SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2005-04-28 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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation IL4, ARG2, CASP4 ALKBH5 4445/4885KMT2A 3219/4885LMNA 1826/4885

“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.