SCHEMBL4159499

SCHEMBL4159499

COc1ccccc1OCCN1C(=O)C2(NC(=O)NC2=O)c2cc(F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 12/20 0.43
AKR1A1 P14550 9/20 0.43
PARK7 Q99497 1/20 0.40
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTT P42858 1/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PLA2G7 Q13093 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4169530 0.90 L3MBTL1 (0.42) POLBHSD17B10HTTGAAKDM4E
SCHEMBL4170642 0.89 AKR1B1 (0.42) AKR1B1AKR1A1POLBHSD17B10HTT
SCHEMBL4167874 0.89 POLB (0.44) AKR1B1POLBHSD17B10HTTGAA
SCHEMBL4176442 0.87 AKR1A1 (0.46) AKR1B1AKR1A1PARK7HTTGAA
SCHEMBL4164837 0.86 AKR1B1 (0.48) AKR1B1AKR1A1PARK7POLB
SCHEMBL4167219 0.84 PLA2G7 (0.51) AKR1B1AKR1A1PARK7PLA2G7
SCHEMBL4174577 0.82 AKR1B1 (0.46) AKR1B1AKR1A1PARK7
SCHEMBL4171777 0.82 AKR1B1 (0.46) AKR1B1AKR1A1PARK7
SCHEMBL4167852 0.80 POLB (0.43) AKR1B1AKR1A1POLBHSD17B10HTT
SCHEMBL4164986 0.79 PARK7 (0.64) AKR1B1AKR1A1PARK7ALDH1A1

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-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 US claimed
US-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 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-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 TRPV1, TRPV5, TRPV2 AKR1B1 344/4885AKR1A1 310/4885PARK7 1295/4885

“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.