SCHEMBL13653124

SCHEMBL13653124

CCOC(=O)Cn1nc(Br)c2cccnc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ GAA P10253 2/20 0.47
▸ CYP2C19 P33261 3/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ TSHR P16473 3/20 0.44
▸ HTT P42858 1/20 0.43
▸ XDH P47989 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ SAE1 Q9UBE0 1/20 0.42
▸ UBA2 Q9UBT2 1/20 0.42
▸ ELANE P08246 3/20 0.42
▸ POLB P06746 1/20 0.41

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
SCHEMBL1638661 0.87 L3MBTL1 (0.53) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL1638662 0.85 CYP2C19 (0.49) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL1639394 0.85 MEN1 (0.53) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL15492976 0.81 KMT2A (0.50) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL1639813 0.80 CYP1A2 (0.47) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL30509506 0.77 L3MBTL1 (0.45) L3MBTL1ELANE
SCHEMBL10530844 0.75 GAA (0.48) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL1638688 0.75 SMN1; SMN2 (0.51) MEN1KMT2AGAATSHRHTT
SCHEMBL1638885 0.74 MEN1 (0.47) MEN1KMT2AGAACYP2C19CYP1A2
SCHEMBL1639229 0.74 GAA (0.47) MEN1KMT2AGAACYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090252779-A1 AZAINDAZOLE COMPOUNDS AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2009-10-08 — — 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-20090252779-A1 AZAINDAZOLE COMPOUNDS AND METHODS OF USE CCR1, CCR3, CCR4 MEN1 4604/4885KMT2A 3304/4885GAA 3352/4885

“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.

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