SCHEMBL269060

SCHEMBL269060

Cc1ccc(C=NNC(=O)c2cc(Cl)ccc2NC(=O)c2ccncc2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
PKM P14618 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPT P10636 3/20 0.51
RECQL P46063 1/20 0.51
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 3/20 0.49
MEN1 O00255 2/20 0.49
MITF O75030 1/20 0.49
GPR174 Q9BXC1 1/20 0.49
POLB P06746 3/20 0.49
CTDSP1 Q9GZU7 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PSMD14 O00487 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
CYP2D6 P10635 2/20 0.48
LMNA P02545 1/20 0.47

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
SCHEMBL269059 1.00 NPC1 (0.53) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL266521 0.90 L3MBTL1 (0.65) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL266520 0.90 L3MBTL1 (0.65) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL267067 0.89 KMT2A (0.53) NPC1RAB9APKML3MBTL1MAPT
SCHEMBL267066 0.89 KMT2A (0.53) NPC1RAB9APKML3MBTL1MAPT
SCHEMBL266960 0.88 NPC1 (0.53) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL266961 0.88 NPC1 (0.53) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL265302 0.87 CYP2D6 (0.55) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL265301 0.87 CYP2D6 (0.55) NPC1RAB9APKMSMN1; SMN2L3MBTL1
SCHEMBL265191 0.87 PKM (0.71) NPC1RAB9APKMSMN1; SMN2L3MBTL1

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 NPC1 102/4885RAB9A 883/4885PKM 1697/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 NPC1 115/4885RAB9A 1362/4885PKM 1916/4885

“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.