SCHEMBL10224980

SCHEMBL10224980

O=C(NC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)SOOO

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
MDH1 P40925 1/20 0.38
MDH2 P40926 1/20 0.38
TSHR P16473 1/20 0.36
EPHX2 P34913 3/20 0.35
DPP7 Q9UHL4 1/20 0.34
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
DPP4 P27487 4/20 0.34
MCHR1 Q99705 1/20 0.33
DPP8 Q6V1X1 2/20 0.32
DPP9 Q86TI2 2/20 0.32

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
SCHEMBL10224986 0.86 EPHX2 (0.44) ALDH1A1EPHX2
SCHEMBL10224953 0.85 MDH1 (0.42) ALDH1A1MDH1MDH2TSHREPHX2
SCHEMBL10225003 0.77 EPHX2 (0.45) TSHREPHX2
SCHEMBL2603025 0.75 PKM (0.31)
SCHEMBL10224985 0.75 EPHX2 (0.37) EPHX2CNR1CNR2DPP4
SCHEMBL10284599 0.73 ALDH1A1 (0.41) ALDH1A1MDH1MDH2TSHREPHX2
SCHEMBL12997544 0.72 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2603066 0.72 SCN9A (0.34) ALDH1A1
SCHEMBL13758555 0.70 CNR2 (0.43) ALDH1A1MDH1MDH2TSHREPHX2
SCHEMBL12972112 0.70 ALDH1A1 (0.45) ALDH1A1TSHR

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-8148044-B2 Positive photosensitive composition FUJIFILM CORPORATION (JP) 2012-04-03 US disclosed
US-20100136479-A1 POSITIVE PHOTOSENSITIVE COMPOSITION FUJIFILM CORPORATION (JP) 2010-06-03 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-20100136479-A1 POSITIVE PHOTOSENSITIVE COMPOSITION AFF1, F12, AFF2 ALDH1A1 2858/4885MDH1 4730/4885MDH2 4750/4885

“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.