SCHEMBL5110184

SCHEMBL5110184

c1ccc(-c2cc3ccccc3n3nnnc23)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.52
KMT2A Q03164 7/20 0.52
TOP1 P11387 2/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
TP53 P04637 4/20 0.38
NPC1 O15118 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 10/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
TNKS O95271 3/20 0.38
BRD4 O60885 1/20 0.38
BRD2 P25440 1/20 0.38
BRD3 Q15059 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
HSD17B10 Q99714 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 3/20 0.36

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
SCHEMBL5114484 0.85 CUL4A (0.48) MEN1KMT2ASMN1; SMN2TP53NPC1
SCHEMBL4489136 0.79 KMT2A (0.57) MEN1KMT2ATOP1SMN1; SMN2TSHR
SCHEMBL5109662 0.76 MEN1 (0.51) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL14501908 0.72 MEN1 (0.60) MEN1KMT2ATOP1SMN1; SMN2TP53
SCHEMBL14209236 0.69 KMT2A (0.56) MEN1KMT2ATOP1SMN1; SMN2NPC1
SCHEMBL11572827 0.68 DAO (0.51) KMT2ASMN1; SMN2TP53NPC1KDM4E
SCHEMBL4497665 0.68 MEN1 (0.55) MEN1KMT2ATOP1SMN1; SMN2TSHR
SCHEMBL4499976 0.68 KMT2A (0.51) MEN1KMT2ATOP1SMN1; SMN2TP53
SCHEMBL4487724 0.67 KMT2A (0.54) MEN1KMT2ATOP1SMN1; SMN2NPC1
SCHEMBL21534086 0.66 KMT2A (0.56) MEN1KMT2ASMN1; SMN2TP53NPC1

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 9 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-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-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 (2 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 MEN1 4880/4885KMT2A 4081/4885TOP1 3744/4885
US-20050090521-A1 HCV inhibitors and methods of using them HAVCR2, GLS2, EIF2AK2 MEN1 4880/4885KMT2A 4081/4885TOP1 3744/4885

“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.