SCHEMBL266049

SCHEMBL266049

CCN(CC)CCNCc1cccc(C(=O)Nc2sc3c(c2C(=O)NN)CCCC3)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.54
MEN1 O00255 6/20 0.54
POLB P06746 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
FLT3 P36888 4/20 0.52
KIF11 P52732 1/20 0.52
MAPT P10636 3/20 0.51
TP53 P04637 1/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.50
NOD1 Q9Y239 1/20 0.49
KDM4E B2RXH2 1/20 0.48
AMY1A P0DUB6 1/20 0.48

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
SCHEMBL5788776 0.92 MEN1 (0.61) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL265899 0.89 MAPT (0.61) NPSR1MAPTTP53KDM4E
SCHEMBL266185 0.87 MAPT (0.59) KMT2AMEN1NPSR1MAPTTP53
SCHEMBL16420883 0.85 MAPT (0.60) KMT2AMEN1POLBMAPTTP53
SCHEMBL269494 0.83 SLC34A2 (0.50) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL269495 0.83 SLC34A2 (0.50) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL267616 0.83 SLC34A2 (0.51) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL267784 0.83 SLC34A2 (0.51) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL267615 0.83 SLC34A2 (0.51) KMT2AMEN1POLBNPSR1FLT3
SCHEMBL267785 0.83 SLC34A2 (0.51) KMT2AMEN1POLBNPSR1FLT3

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 KMT2A 4564/4885MEN1 1194/4885POLB 3843/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 KMT2A 4603/4885MEN1 1638/4885POLB 3761/4885

“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.