SCHEMBL1890973

SCHEMBL1890973

Cc1cc(O)c(C(=O)Nc2nc3ccc(F)cc3[nH]2)c(=O)n1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.48
RAB9A P51151 6/20 0.47
NPC1 O15118 5/20 0.47
BACE1 P56817 1/20 0.47
RPS6KA2 Q15349 1/20 0.44
KDR P35968 2/20 0.44
ADORA3 P0DMS8 1/20 0.44
PTGS1 P23219 1/20 0.44
MAPK1 P28482 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
KDM4E B2RXH2 1/20 0.44
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ABL1 P00519 1/20 0.44
HRH4 Q9H3N8 2/20 0.42
HTT P42858 2/20 0.41
MAPT P10636 2/20 0.41
S1PR2 O95136 1/20 0.41

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
SCHEMBL1890971 0.92 RAB9A (0.47) IRAK4RAB9ANPC1BACE1KDM4E
SCHEMBL1883579 0.88 RAB9A (0.59) IRAK4RAB9ANPC1RPS6KA2PKM
SCHEMBL1884510 0.86 IRAK4 (0.48) IRAK4RAB9ANPC1BACE1RPS6KA2
SCHEMBL1890286 0.86 RAB9A (0.57) RAB9ANPC1PKMSMN1; SMN2HTT
SCHEMBL1883576 0.81 RAB9A (0.58) IRAK4RAB9ANPC1SMN1; SMN2HRH4
SCHEMBL1884504 0.77 RAB9A (0.45) IRAK4RAB9ANPC1BACE1KDR
SCHEMBL1889444 0.77 IRAK4 (0.42) IRAK4RAB9ANPC1BACE1RPS6KA2
SCHEMBL12417686 0.73 RAB9A (0.53) RAB9ANPC1KDM4ETP53SMN1; SMN2
SCHEMBL1889246 0.72 RAB9A (0.52) RAB9ANPC1RPS6KA2KDM4ETP53
SCHEMBL30369772 0.72 NPC1 (0.71) IRAK4RAB9ANPC1BACE1KDR

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
EP-1887002-B1 CARBOXAMIDE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2015-08-26 EP disclosed
US-8304437-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-06 US disclosed
US-20110172276-A1 CARBOXAMIDE COMPOUND AND USE OF THE SAME ARIMORI SADAYUKI 2011-07-14 US disclosed
US-7935716-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-03 US disclosed
US-20090076063-A1 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-19 US disclosed
EP-1887002-A1 CARBOXAMIDE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-02-13 EP 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-20090076063-A1 Carboxamide compound and use of the same CBR3, SIRT2, SIRT1 IRAK4 2187/4885RAB9A 1024/4885NPC1 1710/4885
US-20110172276-A1 CARBOXAMIDE COMPOUND AND USE OF THE SAME CBR3, SIRT2, SIRT1 IRAK4 2187/4885RAB9A 1024/4885NPC1 1710/4885

“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.