SCHEMBL21136003

SCHEMBL21136003

CC(C)C(=O)OC(F)(CC12CC3CC(CC(C3)C1)C2)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SCN9A Q15858 4/20 0.32
MAPT P10636 2/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL21135715 0.82 ALDH1A1 (0.35) ALDH1A1KMT2AMEN1L3MBTL1SCN9A
SCHEMBL21136609 0.76 EPHX1 (0.33) ALDH1A1KMT2AMEN1SCN9A
SCHEMBL21136386 0.76 NPSR1 (0.38) ALDH1A1SMN1; SMN2KMT2ANPSR1SCN9A
SCHEMBL21136587 0.73 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL21135928 0.73 EPHX2 (0.36) ALDH1A1SMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL21136009 0.73 ALDH1A1 (0.30) ALDH1A1L3MBTL1
SCHEMBL21136970 0.71 SMN1; SMN2 (0.34) ALDH1A1SMN1; SMN2KMT2ANPSR1SCN9A
SCHEMBL3790410 0.71 ALDH1A1 (0.36) ALDH1A1HSD17B10EPHX2
SCHEMBL21135981 0.71 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1SCN9AHSD17B10
SCHEMBL21136000 0.70 LMNA (0.30) HSD17B10

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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2019-06-27 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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE RER1, ACTR5, RAD51 ALDH1A1 1556/4885SMN1; SMN2 3245/4885KMT2A 3332/4885

“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.