SCHEMBL1040193

SCHEMBL1040193

CCCCOc1c2ccccc2c(C=O)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.59
TDP1 Q9NUW8 2/20 0.59
GAA P10253 1/20 0.59
SLC2A1 P11166 3/20 0.45
LTA4H P09960 2/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
PADI4 Q9UM07 1/20 0.39
CCNE2 O96020 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL29363526 0.85 LTA4H (0.52) L3MBTL1TDP1GAASLC2A1LTA4H
SCHEMBL442080 0.85 LTA4H (0.52) L3MBTL1TDP1GAASLC2A1LTA4H
SCHEMBL10488258 0.84 GAA (0.44) L3MBTL1TDP1GAASLC2A1CYP1A2
SCHEMBL10488312 0.83 L3MBTL1 (0.41) L3MBTL1TDP1GAACYP1A2CYP2C9
SCHEMBL9466054 0.83 PADI4 (0.43) L3MBTL1TDP1GAASLC2A1ADRB2
SCHEMBL27262240 0.81 LTA4H (0.48) L3MBTL1TDP1GAASLC2A1LTA4H
SCHEMBL10488272 0.81 PADI4 (0.44) L3MBTL1TDP1GAAADRB2ADRB1
SCHEMBL28075742 0.80 LTA4H (0.47) L3MBTL1TDP1GAASLC2A1LTA4H
SCHEMBL600606 0.79 LTA4H (0.52) L3MBTL1TDP1GAALTA4HCYP1A2
SCHEMBL347692 0.79 LTA4H (0.50) L3MBTL1TDP1GAASLC2A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2270114-B1 PHOTOBASE GENERATOR SAN APRO LTD (JP) 2014-07-09 EP disclosed
US-8329771-B2 Photobase generator SAN-APRO LIMITED (JP) 2012-12-11 US disclosed
US-20110028585-A1 PHOTOBASE GENERATOR SAN-APRO LIMITED (JP) 2011-02-03 US disclosed
EP-2270114-A1 PHOTOBASE GENERATOR San-Apro Limited (JP) 2011-01-05 EP disclosed
US-4803226-A ANTITUMOR AGENTS BURROUGHS WELLCOME CO. (US) 1989-02-07 US disclosed
US-4803221-A Anthracene derivatives BURROUGHS WELLCOME CO. (US) 1989-02-07 US disclosed
EP-0125701-B1 POLYCYCLIC AROMATIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1988-08-03 EP disclosed
US-4719047-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1988-01-12 US disclosed
US-4719049-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1988-01-12 US disclosed
EP-0125701-A2 Polycyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1984-11-21 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 (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-20110028585-A1 PHOTOBASE GENERATOR CCKBR, XDH, PPOX L3MBTL1 3526/4885TDP1 872/4885GAA 870/4885

“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.