SCHEMBL5117130

SCHEMBL5117130

O=S(=O)(c1ccccc1)c1cc2ccccc2n2nnnc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
KDM4E B2RXH2 11/20 0.43
ALDH1A1 P00352 8/20 0.43
HTR6 P50406 3/20 0.41
PKM P14618 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 5/20 0.41
MAPT P10636 5/20 0.40
TNKS O95271 2/20 0.40
RAB9A P51151 1/20 0.40
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
RECQL P46063 1/20 0.39
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL4497665 0.72 MEN1 (0.55) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4489136 0.72 KMT2A (0.57) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL14501908 0.71 MEN1 (0.60) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL11326239 0.71 KMT2A (0.53) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL14209236 0.71 KMT2A (0.56) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5460995 0.70 KDM4E (0.44) MEN1KMT2AKDM4EPKMHPGD
SCHEMBL8019079 0.69 KDM4E (0.51) KDM4EALDH1A1HTR6HPGDMAPT
SCHEMBL4497379 0.69 MEN1 (0.54) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL21037223 0.68 KMT2A (0.56) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL15131095 0.68 KMT2A (0.56) MEN1KMT2AKDM4EALDH1A1SMN1; 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 6 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-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-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 4081/4885KDM4E 3202/4885
US-20050090521-A1 HCV inhibitors and methods of using them HAVCR2, GLS2, EIF2AK2 MEN1 4880/4885KMT2A 4081/4885KDM4E 3202/4885

“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.