SCHEMBL274290

SCHEMBL274290

Cc1ccc(/C=N/NC(=O)c2cc(I)ccc2NC(=O)c2cccc(CN3CCC(N4CCCCC4)CC3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 2/20 0.42
SLC34A2 O95436 4/20 0.42
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ACKR3 P25106 2/20 0.41
POLB P06746 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL265952 1.00 MEN1 (0.42) MEN1NPC1RAB9AKMT2ASLC34A2
SCHEMBL273682 0.94 NPC1 (0.44) MEN1NPC1RAB9AKMT2ASLC34A2
SCHEMBL267724 0.94 NPC1 (0.44) MEN1NPC1RAB9AKMT2ASLC34A2
SCHEMBL268140 0.93 ACKR3 (0.45) MEN1KMT2ASLC34A2CYP3A4MAPT
SCHEMBL273680 0.93 ACKR3 (0.45) MEN1KMT2ASLC34A2CYP3A4MAPT
SCHEMBL273695 0.93 ACKR3 (0.44) SLC34A2TDP1ACKR3SIGMAR1
SCHEMBL265724 0.93 ACKR3 (0.44) SLC34A2TDP1ACKR3SIGMAR1
SCHEMBL273693 0.93 L3MBTL1 (0.44) MEN1NPC1RAB9AKMT2ASLC34A2
SCHEMBL268087 0.93 L3MBTL1 (0.44) MEN1NPC1RAB9AKMT2ASLC34A2
SCHEMBL265525 0.92 MAPT (0.47) MEN1NPC1RAB9AKMT2ASLC34A2

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 MEN1 1638/4885NPC1 115/4885RAB9A 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.