SCHEMBL9034893

SCHEMBL9034893

N#Cc1c(Br)c(C(F)(F)F)n(COC(=O)C2CCCO2)c1-c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
RAB9A P51151 3/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
KDM4E B2RXH2 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
OXTR P30559 1/20 0.32
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NPC1 O15118 1/20 0.31
KMT2A Q03164 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL8994464 0.87 L3MBTL1 (0.34) ALDH1A1LMNAGLARXFP1KDM4E
SCHEMBL8994395 0.86 ALDH1A1 (0.33) ALDH1A1LMNARAB9ARXFP1SMN1; SMN2
SCHEMBL9035868 0.80 ALDH1A1 (0.38) ALDH1A1LMNAGLARXFP1KDM4E
SCHEMBL8994383 0.79 GPR88 (0.35) RXFP1SMN1; SMN2MAPTPOLB
SCHEMBL8994468 0.79 RXFP1 (0.35) ALDH1A1LMNAGLARXFP1KDM4E
SCHEMBL8994386 0.78 PAX8 (0.35) ALDH1A1LMNARAB9ARXFP1SMN1; SMN2
SCHEMBL8994390 0.78 L3MBTL1 (0.35) ALDH1A1LMNAGLARXFP1KDM4E
SCHEMBL9037689 0.77 LMNA (0.39) ALDH1A1LMNARAB9ARXFP1KDM4E
SCHEMBL9017343 0.76 KMT2A (0.44) ALDH1A1GLARAB9ARXFP1KDM4E
SCHEMBL5819212 0.76 KDM4E (0.34) ALDH1A1LMNAGLARAB9ARXFP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594940-B1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594940-A1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP claimed
US-5286741-A N-oxy- and thioalkylcarbonyloxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-02-15 US claimed