SCHEMBL4489136

SCHEMBL4489136

c1ccc(-c2cc3ccccc3n3nnnc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.57
MEN1 O00255 9/20 0.57
KDM4E B2RXH2 11/20 0.44
MAPT P10636 7/20 0.44
TNKS O95271 4/20 0.44
RAB9A P51151 2/20 0.44
HPGD P15428 5/20 0.43
HSD17B10 Q99714 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 3/20 0.43
TSHR P16473 3/20 0.42
MAPK1 P28482 3/20 0.42
HTT P42858 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TOP1 P11387 2/20 0.41
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL5109662 0.87 MEN1 (0.51) KMT2AMEN1KDM4EHPGDHSD17B10
Tetrazolast SCHEMBL1814396 0.78 KMT2A (0.51) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL14501908 0.77 MEN1 (0.60) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL4497665 0.75 MEN1 (0.55) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL14209236 0.73 KMT2A (0.56) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL15131095 0.73 KMT2A (0.56) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL11326239 0.72 KMT2A (0.53) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL5117130 0.72 MEN1 (0.51) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL5103400 0.71 CUL4A (0.51) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL4487724 0.71 KMT2A (0.54) KMT2AMEN1KDM4EMAPTTNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 US disclosed
US-20050090521-A1 HCV inhibitors and methods of using them RIGEL PHARMACEUTICALS, INC. 2005-04-28 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 (3 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-20070149520-A1 HCV Inhibitors And Methods Of Using Them HAVCR2, GLS2, EIF2AK2 KMT2A 4081/4885MEN1 4880/4885KDM4E 3202/4885
US-20050090521-A1 HCV inhibitors and methods of using them HAVCR2, GLS2, EIF2AK2 KMT2A 4081/4885MEN1 4880/4885KDM4E 3202/4885
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors HAVCR2, PYGL, HCCS KMT2A 4422/4885MEN1 4682/4885KDM4E 4239/4885

“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.