SCHEMBL5876550

SCHEMBL5876550

Cc1ccc(S(=O)(=O)n2nc(NC3CCC3)c3c2CC(c2cccc(F)c2)(c2cccc(F)c2)C=C3)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.35
ALDH1A1 P00352 2/20 0.34
GPR6 P46095 2/20 0.31
ACHE P22303 1/20 0.31
USP2 O75604 1/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CCR6 P51684 1/20 0.31
GLA P06280 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA1 P30542 1/20 0.31
CYP2C19 P33261 1/20 0.31
NOD2 Q9HC29 1/20 0.31
NOD1 Q9Y239 1/20 0.31
MAP4K4 O95819 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
SCHEMBL5876321 0.98 KMT2A (0.34) KMT2AALDH1A1GPR6ACHEUSP2
SCHEMBL5876629 0.97 KMT2A (0.36) KMT2AALDH1A1GPR6MEN1MAPT
SCHEMBL5877322 0.94 GPR6 (0.36) KMT2AALDH1A1GPR6USP2MAPK1
SCHEMBL5876201 0.90 USP2 (0.34) KMT2AALDH1A1GPR6ACHEUSP2
SCHEMBL5876672 0.90 KMT2A (0.35) KMT2AALDH1A1ACHEMEN1MAPT
SCHEMBL5876198 0.90 USP2 (0.37) KMT2AALDH1A1ACHEUSP2MAPK1
SCHEMBL5877100 0.89 KMT2A (0.34) KMT2AALDH1A1USP2MAPK1MEN1
SCHEMBL5876456 0.89 CCR6 (0.37) KMT2AALDH1A1USP2MAPK1MEN1
SCHEMBL5877370 0.89 MAPT (0.32) KMT2AALDH1A1GPR6ACHEUSP2
SCHEMBL5877528 0.86 MAPT (0.33) KMT2AALDH1A1USP2MAPK1MEN1

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-7119115-B2 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2006-10-10 US disclosed
US-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2004-08-19 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-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology IDO1, IDO2, INMT KMT2A 2326/4885ALDH1A1 166/4885GPR6 986/4885

“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.