SCHEMBL274849

SCHEMBL274849

Cc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2NC(=O)c2cnc3ccccc3n2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.53
MAPT P10636 6/20 0.53
RAB9A P51151 4/20 0.53
GAA P10253 1/20 0.53
FAAH O00519 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.42
BRAF P15056 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 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
SCHEMBL268292 1.00 NPC1 (0.53) NPC1MAPTRAB9AGAAFAAH
SCHEMBL273516 0.87 NPC1 (0.53) NPC1MAPTRAB9AGAAKDM4E
SCHEMBL265842 0.87 NPC1 (0.53) NPC1MAPTRAB9AGAAKDM4E
SCHEMBL274846 0.86 SLC34A2 (0.53) NPC1MAPTRAB9AGAAFAAH
SCHEMBL266630 0.86 SLC34A2 (0.53) NPC1MAPTRAB9AGAAFAAH
SCHEMBL268921 0.84 AURKA (0.44) NPC1MAPTRAB9AFAAHKDM4E
SCHEMBL274464 0.84 AURKA (0.44) NPC1MAPTRAB9AFAAHKDM4E
SCHEMBL267066 0.80 KMT2A (0.53) NPC1MAPTRAB9AGAAKDM4E
SCHEMBL267067 0.80 KMT2A (0.53) NPC1MAPTRAB9AGAAKDM4E
SCHEMBL269060 0.79 NPC1 (0.53) NPC1MAPTRAB9AGAAKDM4E

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-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-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US 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 (1 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-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 NPC1 115/4885MAPT 4648/4885RAB9A 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.