SCHEMBL267883

SCHEMBL267883

Cc1cccc(/C=N/NC(=O)c2cc(Br)ccc2NC(=O)c2ccc(C(S)c3ccncc3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 4/20 0.47
PKM P14618 2/20 0.47
POLB P06746 5/20 0.47
TDP1 Q9NUW8 3/20 0.47
PLEC Q15149 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
CYP2D6 P10635 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
GUSB P08236 1/20 0.41

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
SCHEMBL267154 0.94 RAB9A (0.50) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL267601 0.91 L3MBTL1 (0.53) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL266914 0.90 RAB9A (0.63) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL266915 0.90 RAB9A (0.63) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL266206 0.90 RAB9A (0.47) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL266018 0.89 NPC1 (0.46) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL267317 0.89 RAB9A (0.55) RAB9ASMN1; SMN2NPC1POLBTDP1
SCHEMBL266694 0.86 NPC1 (0.48) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL269019 0.85 NPC1 (0.53) RAB9ASMN1; SMN2NPC1PKMPOLB
SCHEMBL266992 0.85 RAB9A (0.45) RAB9ASMN1; SMN2NPC1PKMPOLB

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 RAB9A 883/4885SMN1; SMN2 3975/4885NPC1 102/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 RAB9A 1362/4885SMN1; SMN2 4253/4885NPC1 115/4885

“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.