SCHEMBL267306

SCHEMBL267306

Cc1csc(NC(=O)c2cccc(CN3CCC(N4CCCCC4)CC3)c2)c1C(=O)NN=Cc1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 6/20 0.49
ACKR3 P25106 6/20 0.43
PKM P14618 1/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
NFKB1 P19838 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SLC34A1 Q06495 1/20 0.38
SLC34A3 Q8N130 1/20 0.38
SLC20A1 Q8WUM9 1/20 0.38
TP53 P04637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL274311 1.00 SLC34A2 (0.49) SLC34A2ACKR3PKMNPC1CYP1A2
SCHEMBL268995 0.94 SLC34A2 (0.49) SLC34A2ACKR3NPC1CYP3A4RAB9A
SCHEMBL273735 0.94 SLC34A2 (0.49) SLC34A2ACKR3NPC1CYP3A4RAB9A
SCHEMBL273730 0.92 SLC34A2 (0.50) SLC34A2ACKR3CYP3A4
SCHEMBL266272 0.92 SLC34A2 (0.50) SLC34A2ACKR3CYP3A4
SCHEMBL273733 0.91 SLC34A2 (0.49) SLC34A2ACKR3NPC1CYP3A4RAB9A
SCHEMBL268185 0.91 SLC34A2 (0.49) SLC34A2ACKR3NPC1CYP3A4RAB9A
SCHEMBL265157 0.91 SLC34A2 (0.56) SLC34A2ACKR3PKMNPC1CYP1A2
SCHEMBL265158 0.91 SLC34A2 (0.56) SLC34A2ACKR3PKMNPC1CYP1A2
SCHEMBL265864 0.89 SLC34A2 (0.49) SLC34A2ACKR3PKMNPC1CYP1A2

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 SLC34A2 6/4885ACKR3 751/4885PKM 1697/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 SLC34A2 2/4885ACKR3 809/4885PKM 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.