SCHEMBL10947293

SCHEMBL10947293

CC(=O)c1ccc2c(c1)C(=O)c1cc(C(C)=O)ccc1-2

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.71
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
MAPT P10636 2/20 0.55
TTR P02766 1/20 0.53
PTPRC P08575 2/20 0.52
HTR7 P34969 1/20 0.47
HTR2B P41595 1/20 0.47
ALDH1A1 P00352 2/20 0.47
PKM P14618 1/20 0.47
HSD17B1 P14061 1/20 0.47
MEN1 O00255 1/20 0.47
MAOA P21397 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ATM Q13315 1/20 0.45
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TERT O14746 2/20 0.44

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
SCHEMBL31268599 0.92 S100A4 (0.86) S100A4NPC1RAB9AMAPTTTR
SCHEMBL10530992 0.92 TTR (0.67) S100A4NPC1RAB9AMAPTTTR
SCHEMBL8014885 0.92 S100A4 (0.86) S100A4NPC1RAB9AMAPTTTR
SCHEMBL10881228 0.90 S100A4 (0.82) S100A4NPC1RAB9AMAPTTTR
SCHEMBL8033807 0.88 S100A4 (0.73) S100A4NPC1RAB9AMAPTPTPRC
SCHEMBL6259661 0.88 S100A4 (0.93) S100A4NPC1RAB9AMAPTTTR
SCHEMBL9423385 0.88 S100A4 (0.93) S100A4NPC1RAB9AMAPTTTR
Dimethylamine SCHEMBL7241455 0.87 S100A4 (0.77) S100A4NPC1RAB9AMAPTTTR
SCHEMBL5820822 0.85 S100A4 (0.65) S100A4NPC1RAB9AMAPTTTR
SCHEMBL2599394 0.84 S100A4 (1.00) S100A4NPC1RAB9AMAPTTTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11872236-B2 Pharmacological agents for treating ocular diseases CALASIA PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
US-11872236-B2 Pharmacological agents for treating ocular diseases CALASIA PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
US-20210154213-A1 PHARMACOLOGICAL AGENTS FOR TREATING OCULAR DISEASES CALASIA PHARMACEUTICALS INC (US) 2021-05-27 US disclosed
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 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 (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-20210154213-A1 PHARMACOLOGICAL AGENTS FOR TREATING OCULAR DISEASES CRYAA, CRYAB, TTR S100A4 128/4885NPC1 1876/4885RAB9A 1655/4885
US-11872236-B2 Pharmacological agents for treating ocular diseases CRYAA, CRYAB, TTR S100A4 128/4885NPC1 1876/4885RAB9A 1655/4885

“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.