SCHEMBL266918

SCHEMBL266918

O=C(Nc1ccc(Br)cc1C(=O)NN=Cc1ccc(F)cc1)c1cccnc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.59
KMT2A Q03164 11/20 0.58
POLB P06746 5/20 0.58
MEN1 O00255 7/20 0.57
RAB9A P51151 4/20 0.57
NPC1 O15118 4/20 0.57
IDE P14735 1/20 0.55
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KLF5 Q13887 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
PKM P14618 1/20 0.51

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
SCHEMBL266917 1.00 GAA (0.59) GAAKMT2APOLBMEN1RAB9A
SCHEMBL266584 0.91 KMT2A (0.59) GAAKMT2APOLBMEN1RAB9A
SCHEMBL266585 0.91 KMT2A (0.59) GAAKMT2APOLBMEN1RAB9A
SCHEMBL267643 0.90 KMT2A (0.57) GAAKMT2APOLBMEN1RAB9A
SCHEMBL267642 0.90 KMT2A (0.57) GAAKMT2APOLBMEN1RAB9A
Hydrochloric Acid SCHEMBL267008 0.90 KMT2A (0.56) GAAKMT2APOLBMEN1RAB9A
Hydrochloric Acid SCHEMBL267009 0.90 KMT2A (0.56) GAAKMT2APOLBMEN1RAB9A
SCHEMBL267169 0.89 KMT2A (0.57) KMT2APOLBMEN1RAB9ANPC1
SCHEMBL267170 0.89 KMT2A (0.57) KMT2APOLBMEN1RAB9ANPC1
SCHEMBL268082 0.88 NPC1 (0.60) KMT2APOLBMEN1RAB9ANPC1

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 GAA 1336/4885KMT2A 4564/4885POLB 3843/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 GAA 1640/4885KMT2A 4603/4885POLB 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.