SCHEMBL273736

SCHEMBL273736

COc1ccc(/C=N/NC(=O)c2c(C)csc2NC(=O)c2cccc(CN3CCC(N4CCCCC4)CC3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 4/20 0.47
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
ACHE P22303 2/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
ACKR3 P25106 3/20 0.42
ENPP2 Q13822 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL267715 1.00 SLC34A2 (0.47) SLC34A2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL268185 0.93 SLC34A2 (0.49) SLC34A2MAPTNPC1RAB9ACYP3A4
SCHEMBL273733 0.93 SLC34A2 (0.49) SLC34A2MAPTNPC1RAB9ACYP3A4
SCHEMBL268995 0.92 SLC34A2 (0.49) SLC34A2MAPTNPC1RAB9ACYP3A4
SCHEMBL273735 0.92 SLC34A2 (0.49) SLC34A2MAPTNPC1RAB9ACYP3A4
SCHEMBL273730 0.91 SLC34A2 (0.50) SLC34A2MAPTCYP3A4CYP2C9ACKR3
SCHEMBL266272 0.91 SLC34A2 (0.50) SLC34A2MAPTCYP3A4CYP2C9ACKR3
SCHEMBL267138 0.91 SLC34A2 (0.54) SLC34A2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL267137 0.91 SLC34A2 (0.54) SLC34A2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL273726 0.90 MAPT (0.45) SLC34A2MAPTKDM4ESMN1; SMN2NPC1

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 SLC34A2 2/4885MAPT 4648/4885KDM4E 4535/4885

“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.