SCHEMBL11389161

SCHEMBL11389161

Cn1cc(C(=O)O)c(=O)c2cc(Cl)c(N3CCNCC3)cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.56
ALDH1A1 P00352 7/20 0.56
KDM4E B2RXH2 7/20 0.56
HPGD P15428 5/20 0.56
HSD17B10 Q99714 5/20 0.56
BRD4 O60885 1/20 0.56
TSHR P16473 1/20 0.56
HTT P42858 1/20 0.56
CYP2J2 P51589 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CYP2C9 P11712 2/20 0.53
CYP1A2 P05177 1/20 0.53
TOP2A P11388 1/20 0.53
TOP2B Q02880 1/20 0.53
DRD3 P35462 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATP6V1B2 P21281 1/20 0.42
TBXA2R P21731 1/20 0.42
EDNRA P25101 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
SCHEMBL11391125 0.88 ALDH1A1 (0.56) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL11401876 0.86 LMNA (0.61) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL11392814 0.86 ALDH1A1 (0.74) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30605634 0.86 ALDH1A1 (0.74) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10753542 0.85 KDM4E (0.77) LMNAALDH1A1KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL11026221 0.85 ALDH1A1 (0.73) LMNAALDH1A1KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL11025612 0.84 KDM4E (0.76) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10809588 0.83 KDM4E (0.77) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6664480 0.79 LMNA (0.53) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30748678 0.79 KDM4E (0.74) LMNAALDH1A1KDM4EHPGDHSD17B10

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-4292317-A BACTERICIDES FOR GRAM NEGATIVE AND -POSITIVE BACTERIA; ANIMAL GROWTH REGULATORS LABORATORIE ROGER BELLON (FR) 1981-09-29 US disclosed