SCHEMBL267347

SCHEMBL267347

Cc1csc(C(=O)NN=Cc2ccc(F)cc2)c1NC(=O)c1cccc(CN2CCN(CCO)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.46
RAB9A P51151 4/20 0.45
KMT2A Q03164 3/20 0.45
NPC1 O15118 3/20 0.45
MEN1 O00255 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
GAA P10253 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
MAPT P10636 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC34A2 O95436 2/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTDSP1 Q9GZU7 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
SCHEMBL267346 1.00 ENPP2 (0.46) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL268167 0.94 NPC1 (0.42) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL268168 0.94 NPC1 (0.42) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL267507 0.93 PKM (0.46) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL267508 0.93 PKM (0.46) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL267766 0.92 SLC34A2 (0.41) ENPP2L3MBTL1CA1CA2CA7
SCHEMBL267767 0.92 SLC34A2 (0.41) ENPP2L3MBTL1CA1CA2CA7
SCHEMBL269213 0.88 SLC34A2 (0.46) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL269214 0.88 SLC34A2 (0.46) ENPP2RAB9AKMT2ANPC1MEN1
SCHEMBL266135 0.83 SLC34A2 (0.50) ENPP2RAB9ANPC1CYP1A2CYP2C19

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 ENPP2 178/4885RAB9A 883/4885KMT2A 4564/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 ENPP2 191/4885RAB9A 1362/4885KMT2A 4603/4885

“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.