SCHEMBL7577192

SCHEMBL7577192

Cc1ccc(Sc2ncccc2C(=O)O)cc1

nearest known ligand 0.97

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.97
SMN1; SMN2 Q16637 5/20 0.97
GAA P10253 1/20 0.97
TP53 P04637 1/20 0.63
EGLN1 Q9GZT9 1/20 0.57
PKM P14618 1/20 0.55
HTT P42858 2/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
ATM Q13315 1/20 0.50
CYP2C9 P11712 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL2295833 0.87 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2GAAEGLN1PKM
SCHEMBL31544568 0.86 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2GAATP53HTT
SCHEMBL4768446 0.86 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2GAATP53HTT
Hydrochloric Acid SCHEMBL7110024 0.85 ALDH1A1 (0.77) ALDH1A1SMN1; SMN2GAAEGLN1PKM
SCHEMBL2553452 0.85 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2GAATP53EGLN1
SCHEMBL7108755 0.84 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2GAAEGLN1PKM
SCHEMBL1514728 0.81 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2GAATP53EGLN1
SCHEMBL5717798 0.77 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2GAAHTTLMNA
SCHEMBL355357 0.76 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2GAATP53EGLN1
SCHEMBL3111830 0.76 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2GAAHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036059-B1 ADAMANTANE DERIVATIVES ASTRAZENECA UK LTD (GB) 2002-09-18 EP disclosed
US-6303659-B2 Compounds ASTRAZENECA AB (SE) 2001-10-16 US disclosed
US-6258838-B1 Compounds ASTRAZENECA AB (SE) 2001-07-10 US disclosed
US-20010003121-A1 Novel compounds ASTRAZENECA UK LIMITED 2001-06-07 US disclosed
US-6201024-B1 EFFECTIVE P2X7 RECEPTOR ANTAGONISTS FOR USE IN THE TREATMENT OF INFLAMMATORY, IMMUNE OR CARDIOVASCULAR DISORDERS ASTRAZENECA UK LIMITED (GB) 2001-03-13 US disclosed
CN-1284057-A Adamantane derivatives ASTRA ZENECA BRITISH LTD (GB) 2001-02-14 CN disclosed
EP-1036059-A1 ADAMANTANE DERIVATIVES AstraZeneca UK Limited (GB) 2000-09-20 EP disclosed
WO-1999029661-A1 ADAMANTANE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 1999-06-17 WO 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-20010003121-A1 Novel compounds APP, BACE1, CHRNA5 ALDH1A1 1215/4885SMN1; SMN2 1630/4885GAA 254/4885

“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.