SCHEMBL4970256

SCHEMBL4970256

NNc1nc2ccc(C(=O)O)cc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.58
ALDH1A1 P00352 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
TDP1 Q9NUW8 4/20 0.58
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
LMNA P02545 3/20 0.58
MAPT P10636 3/20 0.58
MEN1 O00255 2/20 0.58
ALOX12 P18054 2/20 0.58
KMT2A Q03164 2/20 0.58
GFER P55789 2/20 0.58
GAA P10253 2/20 0.58
PKM P14618 1/20 0.58
MAPK1 P28482 1/20 0.58
HTT P42858 1/20 0.58
NFKB1 P19838 2/20 0.57
NFKB2 Q00653 2/20 0.57
RELA Q04206 2/20 0.57
HSD17B10 Q99714 5/20 0.57

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
SCHEMBL11207412 0.88 DYRK1A (0.72) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL11205987 0.88 NPC1 (0.62) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL13853337 0.84 HSD17B10 (0.61) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL4746038 0.84 LDHA (0.61) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL24729341 0.82 HSD17B10 (0.73) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL29947460 0.82 HSD17B10 (0.73) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL6058154 0.82 DYRK1A (0.77) ALDH1A1SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL19921646 0.81 HSD17B10 (0.60) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL31087734 0.81 SMN1; SMN2 (0.54) KDM4EALDH1A1SMN1; SMN2TDP1NPC1
SCHEMBL23628970 0.81 SMN1; SMN2 (0.54) KDM4EALDH1A1SMN1; SMN2TDP1NPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008118790-A1 DIHYDROINDAZOLE COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-10-02 WO disclosed
US-20080234327-A1 DIHYDROINDAZOLE COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-09-25 US 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 (1 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-20080234327-A1 DIHYDROINDAZOLE COMPOUNDS USEFUL IN TREATING IRON DISORDERS FECH, SLC40A1, HAMP KDM4E 2577/4885ALDH1A1 514/4885SMN1; SMN2 1839/4885

“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.