SCHEMBL4497665

SCHEMBL4497665

O=C(O)c1cc2ccccc2n2nnnc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
TNKS O95271 3/20 0.47
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
KDM4E B2RXH2 4/20 0.43
RAB9A P51151 1/20 0.43
DAO P14920 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
MCL1 Q07820 1/20 0.41
TSHR P16473 3/20 0.40
HSD17B10 Q99714 2/20 0.40
IDO1 P14902 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TOP1 P11387 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
SCHEMBL4497379 0.87 MEN1 (0.54) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL14209282 0.85 LDHA (0.48) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL5102439 0.84 MEN1 (0.51) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL4492654 0.81 MCL1 (0.44) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL4485871 0.81 CCR2 (0.38) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL4495945 0.81 ALDH1A1 (0.44) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL13755948 0.81 TSHR (0.53) MEN1KMT2AMAPTKDM4ERAB9A
SCHEMBL4495523 0.81 TNKS (0.39) MEN1KMT2ATNKSMAPTSMN1; SMN2
SCHEMBL4488936 0.81 MAPT (0.50) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL4482809 0.81 CUL4A (0.49) TNKSMAPTSMN1; SMN2KDM4ERAB9A

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-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

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 4081/4885TNKS 3417/4885
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors HAVCR2, PYGL, HCCS MEN1 4682/4885KMT2A 4422/4885TNKS 2955/4885

“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.