SCHEMBL269451

SCHEMBL269451

Cc1csc(NC(=O)c2cccc(C(S)c3nc[nH]n3)c2)c1C(=O)N/N=C/c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 2/20 0.41
KMT2A Q03164 8/20 0.39
RAB9A P51151 9/20 0.39
NPC1 O15118 7/20 0.39
SMN1; SMN2 Q16637 7/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 5/20 0.39
CTDSP1 Q9GZU7 3/20 0.39
POLB P06746 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
AMY1A P0DUB6 1/20 0.38
XBP1 P17861 1/20 0.37
HTT P42858 1/20 0.37
TYMS P04818 1/20 0.37

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
SCHEMBL268493 0.93 RAB9A (0.44) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL268098 0.91 CTDSP1 (0.37) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL270113 0.90 NPC1 (0.42) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL269096 0.89 GUSB (0.40) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL267434 0.88 MAPT (0.42) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL268192 0.87 SLC34A2 (0.44) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL266125 0.82 HPGD (0.39) KMT2ARAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL266841 0.81 SLC34A2 (0.45) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL269452 0.81 SLC34A2 (0.44) GUSBKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL273729 0.81 SLC34A2 (0.44) GUSBKMT2ARAB9ANPC1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-05-10 US disclosed
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed
US-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-28 US disclosed
EP-1614676-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-01-11 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-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same SLC10A6, SLC7A1, SLC10A1 GUSB 1395/4885KMT2A 4564/4885RAB9A 883/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 GUSB 1859/4885KMT2A 4603/4885RAB9A 1362/4885

“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.