SCHEMBL6825381

SCHEMBL6825381

CC(CNC(=O)Nc1cc(Cl)ccc1Cl)CC(=O)N(CC(=O)NO)CC1CCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.40
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.37
POLB P06746 2/20 0.37
PANK3 Q9H999 1/20 0.36
CYP2C19 P33261 1/20 0.35
RAB9A P51151 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL6825616 0.98 LMNA (0.41) TRPV1LMNAGAAALDH1A1TSHR
SCHEMBL6822383 0.98 LMNA (0.41) TRPV1LMNAGAAALDH1A1TSHR
SCHEMBL6825333 0.93 RAB9A (0.41) LMNAGAAALDH1A1TSHRMAPT
SCHEMBL6825512 0.91 RAB9A (0.43) LMNAGAAALDH1A1TSHRMAPT
SCHEMBL6827787 0.91 RAB9A (0.43) LMNAGAAALDH1A1TSHRMAPT
SCHEMBL6825902 0.90 ALDH1A1 (0.51) LMNAGAAALDH1A1TSHRTP53
SCHEMBL6824964 0.90 TRPV1 (0.42) TRPV1LMNAGAAALDH1A1TSHR
SCHEMBL6827866 0.90 LMNA (0.40) TRPV1LMNAGAAALDH1A1TSHR
SCHEMBL6822351 0.90 LMNA (0.40) TRPV1LMNAGAAALDH1A1TSHR
SCHEMBL6822316 0.90 LMNA (0.40) TRPV1LMNAGAAALDH1A1TSHR

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
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed