SCHEMBL26020573

SCHEMBL26020573

CC(C)(C)Cc1ccc(CCc2ccc(F)cc2C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.45
EPHX2 P34913 2/20 0.37
PPARG P37231 2/20 0.37
SLC6A2 P23975 6/20 0.36
SLC6A4 P31645 6/20 0.36
SLC6A3 Q01959 1/20 0.36
P2RX7 Q99572 5/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL9969387 0.87 IDO1 (0.56) IDO1SLC6A2SLC6A4SLC6A3P2RX7
SCHEMBL26020661 0.85 IDO1 (0.45) IDO1EPHX2PPARGSLC6A2SLC6A4
SCHEMBL26020762 0.77 IDO1 (0.38) IDO1SLC6A2SLC6A4P2RX7
SCHEMBL17071866 0.74 IDO1 (0.56) IDO1EPHX2PPARGSLC6A2SLC6A4
SCHEMBL13020830 0.74 IDO1 (0.43) IDO1SLC6A2SLC6A4P2RX7
SCHEMBL20468369 0.71 AR (0.43) HDAC3HDAC1HDAC2HDAC6PDE3B
SCHEMBL12107918 0.71 CNR1 (0.41) IDO1
SCHEMBL22445529 0.71 IDO1 (0.56) IDO1SLC6A2SLC6A4SLC6A3P2RX7
SCHEMBL28763543 0.71 IDO1 (0.56) IDO1SLC6A2SLC6A4SLC6A3P2RX7
SCHEMBL7782539 0.71 IDO1 (0.61) IDO1SLC6A2SLC6A4SLC6A3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257382-A1 HETEROCYCLIC COMPOUND AND USE THEREOF WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2023-08-17 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-20230257382-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TRPC5, TRPC1, GOT1 IDO1 184/4885EPHX2 3315/4885PPARG 4042/4885

“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.