SCHEMBL13159243

SCHEMBL13159243

CCOC(=O)C(F)(F)COc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PIN1 Q13526 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.42
RECQL P46063 1/20 0.42
MMP8 P22894 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
MAPK10 P53779 1/20 0.42
ALOX15 P16050 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
SCHEMBL28729068 0.83 TDP1 (0.55) POLBNPSR1TDP1NPC1RAB9A
SCHEMBL18725303 0.79 TDP1 (0.47) POLBNPSR1TDP1PIN1NPC1
SCHEMBL1964634 0.79 TDP1 (0.50) POLBNPSR1TDP1PIN1NPC1
SCHEMBL21748648 0.79 SSTR4 (0.51) POLBNPSR1NPC1RAB9AMAPT
SCHEMBL8743568 0.78 ALDH1A1 (0.47) POLBNPSR1PIN1MAPTALDH1A1
SCHEMBL24497220 0.77 POLB (0.50) POLBNPSR1TDP1PIN1NPC1
SCHEMBL2010765 0.77 ALDH1A1 (0.59) POLBNPSR1PIN1SMN1; SMN2MAPT
SCHEMBL28729204 0.77 TDP1 (0.48) NPSR1TDP1NPC1RAB9ASMN1; SMN2
SCHEMBL29281054 0.75 POLB (0.49) POLBNPSR1TDP1PIN1NPC1
SCHEMBL21748963 0.75 SSTR4 (0.51) POLBNPC1RAB9ASMN1; SMN2MAPT

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-20100234379-A1 Dual modulation of endocannabinoid transport and fatty-acid amide hydrolase for treatment of excitotoxicity CONNECTICUT, UNIVERSITY OF 2010-09-16 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-20100234379-A1 Dual modulation of endocannabinoid transport and fatty-acid amide hydrolase for treatment of excitotoxicity FAAH, FAAH2, CNR2 POLB 3457/4885NPSR1 1072/4885TDP1 2380/4885

“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.