SCHEMBL266797

SCHEMBL266797

COC(=O)c1cc(Cl)ccc1NC(=O)c1cccc(CSCCS(=O)(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.48
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 3/20 0.48
RAB9A P51151 2/20 0.48
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
SLC34A2 O95436 1/20 0.44
SLC34A1 Q06495 1/20 0.44
SLC34A3 Q8N130 1/20 0.44
SLC20A1 Q8WUM9 1/20 0.44
SERPINE1 P05121 1/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL265904 0.89 SLC34A2 (0.47) HPGDNPC1SMN1; SMN2RAB9AAKR1C4
SCHEMBL265994 0.81 SLC34A2 (0.57) HPGDALDH1A1NPC1SMN1; SMN2KDM4E
SCHEMBL265993 0.81 SLC34A2 (0.57) HPGDALDH1A1NPC1SMN1; SMN2KDM4E
SCHEMBL267931 0.81 HPGD (0.57) HPGDALDH1A1NPC1SMN1; SMN2KDM4E
SCHEMBL266958 0.80 SLC34A2 (0.60) HPGDALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL266957 0.80 SLC34A2 (0.60) HPGDALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL269874 0.80 SLC34A2 (0.58) HPGDALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL269875 0.80 SLC34A2 (0.58) HPGDALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL267661 0.79 SLC34A2 (0.63) HPGDALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL267662 0.79 SLC34A2 (0.63) HPGDALDH1A1NPC1SMN1; SMN2RAB9A

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 HPGD 2509/4885ALDH1A1 3022/4885NPC1 102/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 HPGD 2407/4885ALDH1A1 2872/4885NPC1 115/4885

“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.