SCHEMBL266992

SCHEMBL266992

Cc1ccc(/C=N/NC(=O)c2cc(Br)ccc2NC(=O)c2cccc(C(S)c3ccncc3)c2)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
PKM P14618 3/20 0.45
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 6/20 0.42
KMT2A Q03164 6/20 0.41
MEN1 O00255 2/20 0.41
IDE P14735 1/20 0.41
CYP2D6 P10635 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CTDSP1 Q9GZU7 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
PLEC Q15149 1/20 0.39
MAPT P10636 5/20 0.39
HPGD P15428 2/20 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
SCHEMBL266694 0.92 NPC1 (0.48) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL266018 0.92 NPC1 (0.46) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL267154 0.91 RAB9A (0.50) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL266976 0.89 RAB9A (0.48) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL265318 0.88 SLC34A2 (0.48) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL266893 0.86 KMT2A (0.38) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL266961 0.85 NPC1 (0.53) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL266960 0.85 NPC1 (0.53) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL267707 0.85 NPC1 (0.42) RAB9ANPC1PKMSMN1; SMN2LMNA
SCHEMBL267883 0.85 RAB9A (0.56) RAB9ANPC1PKMSMN1; SMN2LMNA

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 883/4885NPC1 102/4885PKM 1697/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 RAB9A 1362/4885NPC1 115/4885PKM 1916/4885

“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.