SCHEMBL26575463

SCHEMBL26575463

CC(=O)c1ccc2c(c1)Cc1cc(C(=O)O)ccc1-2

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.85
RAB9A P51151 2/20 0.85
NPC1 O15118 1/20 0.85
HSD17B1 P14061 1/20 0.72
SRD5A2 P31213 5/20 0.69
SRD5A1 P18405 4/20 0.54
ALDH1A1 P00352 3/20 0.52
PGR P06401 1/20 0.51
CYP1A2 P05177 2/20 0.48
HPGD P15428 1/20 0.48
KCNH2 Q12809 1/20 0.46
TDP2 O95551 1/20 0.46
KDM4E B2RXH2 2/20 0.45
KMT2A Q03164 2/20 0.45
ADRA2A P08913 1/20 0.45
MAOA P21397 1/20 0.45
SLC6A2 P23975 1/20 0.45
HTR2C P28335 1/20 0.45
SLC6A4 P31645 1/20 0.45
HTR2B P41595 1/20 0.45

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
SCHEMBL3399487 0.92 RAB9A (1.00) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL30692090 0.92 RAB9A (1.00) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL27506 0.90 SRD5A2 (0.81) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL31456551 0.90 SRD5A2 (0.81) MAPTRAB9ANPC1HSD17B1SRD5A2
Hydrochloric Acid SCHEMBL9789481 0.88 SRD5A2 (0.79) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL11841857 0.87 MAPT (0.89) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL30976964 0.85 SRD5A2 (0.79) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL1647589 0.85 SRD5A2 (0.79) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL407340 0.84 MAPT (0.82) MAPTRAB9ANPC1HSD17B1SRD5A2
SCHEMBL26575457 0.84 RAB9A (0.82) MAPTRAB9ANPC1HSD17B1SRD5A2

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
US-20230330045-A1 THE ANTIVIRAL DRUG TILORONE IS A POTENT AND SELECTIVE INHIBITOR OF ACETYLCHOLINESTERASE COLLABORATIONS PHARMACEUTICALS, INC. 2023-10-19 US disclosed
US-20230330045-A1 THE ANTIVIRAL DRUG TILORONE IS A POTENT AND SELECTIVE INHIBITOR OF ACETYLCHOLINESTERASE COLLABORATIONS PHARMACEUTICALS, INC. 2023-10-19 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-20230330045-A1 THE ANTIVIRAL DRUG TILORONE IS A POTENT AND SELECTIVE INHIBITOR OF ACETYLCHOLINESTERASE ACHE, BCHE, ACE MAPT 886/4885RAB9A 2916/4885NPC1 3609/4885

“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.