SCHEMBL17050327

SCHEMBL17050327

CCC1(CC2(CC3(CCC(=O)O)c4ccccc4-c4ccccc43)COC2)c2ccccc2-c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.58
NPC1 O15118 1/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PDK2 Q15119 3/20 0.31
PGR P06401 1/20 0.31
HTT P42858 1/20 0.31
CYP2C19 P33261 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL15691719 0.94 APEX1 (0.67) APEX1NPC1THRBTDP1MEN1
SCHEMBL17050245 0.87 APEX1 (0.73) APEX1NPC1THRBTDP1PDK2
SCHEMBL17050168 0.85 PGR (0.35) APEX1KMT2APGRCYP2C19
SCHEMBL15691738 0.81 APEX1 (0.43) APEX1MEN1KMT2APDK2
SCHEMBL15691712 0.81 APEX1 (0.46) APEX1MEN1KMT2APDK2CYP2C19
SCHEMBL15691746 0.80 APEX1 (0.49) APEX1THRBTDP1KMT2APDK2
SCHEMBL17050313 0.80 APEX1 (0.42) APEX1MEN1KMT2APDK2PGR
SCHEMBL17050256 0.80 APEX1 (0.81) APEX1NPC1THRBTDP1PDK2
SCHEMBL17050188 0.80 PGR (0.38) APEX1PDK2PGR
SCHEMBL15691574 0.79 APEX1 (0.86) APEX1NPC1THRBTDP1MEN1

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-9518150-B2 Resin composition, stretched film, circularly polarizing plate, and image display device MITSUBISHI CHEMICAL CORPORATION (JP) 2016-12-13 US disclosed
US-20150247002-A1 RESIN COMPOSITION, STRETCHED FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2015-09-03 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-20150247002-A1 RESIN COMPOSITION, STRETCHED FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE RAD50, RAD54L, PUF60 APEX1 3376/4885NPC1 4724/4885THRB 3988/4885

“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.