SCHEMBL29699656

SCHEMBL29699656

CN(C)CCOC(=O)CCc1ccccc1

nearest known ligand 0.97

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.74
APP P05067 1/20 0.55
CHRM1 P11229 1/20 0.55
ALOX5 P09917 2/20 0.55
TAAR1 Q96RJ0 1/20 0.52
ALDH1A1 P00352 3/20 0.50
MAPT P10636 1/20 0.49
GAA P10253 1/20 0.49
DNM1 Q05193 1/20 0.49
KMT2A Q03164 1/20 0.49
TRPV1 Q8NER1 1/20 0.48

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
SCHEMBL28182817 0.86 TDP1 (1.00) TDP1APPALOX5ALDH1A1MAPT
SCHEMBL7277555 0.84 CHRM1 (0.52) TDP1CHRM1TAAR1ALDH1A1KMT2A
SCHEMBL11038062 0.83 ALDH1A1 (0.68) TDP1CHRM1ALOX5ALDH1A1GAA
SCHEMBL23694499 0.83 CHRM1 (0.51) TDP1CHRM1ALDH1A1GAADNM1
SCHEMBL9367557 0.83 TDP1 (0.92) TDP1APPALOX5ALDH1A1MAPT
Hydrochloric Acid SCHEMBL28340928 0.82 ALDH1A1 (0.70) TDP1CHRM1ALDH1A1GAAKMT2A
SCHEMBL10751278 0.82 ALDH1A1 (0.66) TDP1CHRM1ALOX5ALDH1A1GAA
SCHEMBL3851800 0.81 TDP1 (0.82) TDP1APPALOX5ALDH1A1MAPT
SCHEMBL27516564 0.81 TDP1 (0.82) TDP1APPALOX5ALDH1A1MAPT
SCHEMBL16488388 0.81 TDP1 (0.70) TDP1APPALOX5ALDH1A1

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-20220170904-A1 SYSTEMS AND METHODS FOR MONITORING BIOLOGICAL TISSUE DEGRADATION ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-06-02 US disclosed