SCHEMBL267600

SCHEMBL267600

Cc1ccc(C=NNC(=O)c2scc(C)c2NC(=O)c2cccc(CN(CC(C)O)CC(C)O)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.43
NPC1 O15118 8/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 6/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 4/20 0.38
LMNA P02545 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 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
SCHEMBL267599 1.00 RAB9A (0.43) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL266191 0.88 RAB9A (0.44) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL266192 0.88 RAB9A (0.44) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL266349 0.87 SLC34A2 (0.48) RAB9ANPC1KMT2ASMN1; SMN2GAA
SCHEMBL266350 0.87 SLC34A2 (0.48) RAB9ANPC1KMT2ASMN1; SMN2GAA
SCHEMBL273918 0.87 SLC34A2 (0.48) RAB9ANPC1KMT2ASMN1; SMN2GAA
SCHEMBL267043 0.84 RAB9A (0.45) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL267042 0.84 RAB9A (0.45) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL266601 0.84 SLC34A2 (0.43) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL266602 0.84 SLC34A2 (0.43) RAB9ANPC1MEN1KMT2ASMN1; 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 RAB9A 883/4885NPC1 102/4885MEN1 1194/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 RAB9A 1362/4885NPC1 115/4885MEN1 1638/4885

“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.