SCHEMBL267434

SCHEMBL267434

COc1ccc(/C=N/NC(=O)c2c(C)csc2NC(=O)c2cccc(C(S)c3nc[nH]n3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
KDM4E B2RXH2 4/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
GUSB P08236 1/20 0.40
TP53 P04637 2/20 0.40
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
HPGD P15428 2/20 0.39
PKM P14618 1/20 0.38
AURKA O14965 2/20 0.38
AMY1A P0DUB6 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
STAT3 P40763 1/20 0.38
STAT1 P42224 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL270113 0.93 NPC1 (0.42) MAPTKMT2AMEN1SMN1; SMN2GUSB
SCHEMBL268493 0.92 RAB9A (0.44) MAPTPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL268098 0.91 CTDSP1 (0.37) MAPTPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL269451 0.88 GUSB (0.41) MAPTPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL268192 0.85 SLC34A2 (0.44) MAPTKDM4EPOLBSMN1; SMN2ALDH1A1
SCHEMBL266125 0.82 HPGD (0.39) MAPTKDM4EPOLBKMT2AMEN1
SCHEMBL269798 0.81 CTDSP1 (0.37) MAPTPOLBKMT2AMEN1SMN1; SMN2
SCHEMBL267435 0.81 MAPT (0.42) MAPTKDM4EPOLBKMT2AMEN1
SCHEMBL273917 0.81 MAPT (0.42) MAPTKDM4EPOLBKMT2AMEN1
SCHEMBL269096 0.79 GUSB (0.40) MAPTPOLBKMT2AMEN1SMN1; SMN2

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 MAPT 4195/4885KDM4E 4468/4885POLB 3843/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 MAPT 4648/4885KDM4E 4535/4885POLB 3761/4885

“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.