SCHEMBL6364973

SCHEMBL6364973

CCCc1c(C(=O)OC)c(C(=O)OC)c(CCC)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.46
MAPK1 P28482 3/20 0.46
LMNA P02545 1/20 0.46
NCEH1 Q6PIU2 2/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.42
KDM4E B2RXH2 4/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL796905 0.94 MEN1 (0.44) NR4A2MAPK1LMNANCEH1CA12
SCHEMBL796328 0.88 KDM4E (0.40) NR4A2MAPK1LMNANCEH1CA12
SCHEMBL797153 0.82 MEN1 (0.44) MAPK1CA12CA1CA2CA7
SCHEMBL797383 0.81 KMT2A (0.43) CA12CA1CA2CA7CA9
SCHEMBL797755 0.79 KDM4E (0.50) NCEH1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10079131 0.79 MEN1 (0.43) MAPK1LMNACA12CA1CA2
SCHEMBL10079130 0.78 MEN1 (0.42) MAPK1LMNACA12CA1CA2
SCHEMBL30881977 0.78 ALDH1A1 (0.52) LMNACA12CA1CA2CA7
SCHEMBL12002083 0.78 ALDH1A1 (0.56) LMNACA12CA1CA2CA7
SCHEMBL70573 0.76 CA12 (0.60) NR4A2MAPK1LMNANCEH1CA12

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-20050240061-A1 Functional thin film JAPAN SCIENCE AND TECHNOLOGY AGENCY 2005-10-27 US disclosed
EP-1493796-A1 FUNCTIONAL THIN FILM Japan Science and Technology Agency (JP) 2005-01-05 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-20050240061-A1 Functional thin film H1-10, H1-0, H1-2 NR4A2 1628/4885MAPK1 1864/4885LMNA 1771/4885

“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.