SCHEMBL7585196

SCHEMBL7585196

CCCc1ccc(OC)c(S(=O)(=O)N2CCN(CC)C(c3ccccc3)C2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
USP2 O75604 3/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PKM P14618 1/20 0.46
POLB P06746 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 3/20 0.43
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.43
ATM Q13315 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
DRD2 P14416 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL7583716 0.86 P2RX7 (0.47) LMNAHTTNPC1RAB9ATSHR
SCHEMBL7590018 0.76 DRD2 (0.41) ALDH1A1USP2LMNAHTTL3MBTL1
Ethane SCHEMBL7590902 0.76 ALDH1A1 (0.40) ALDH1A1USP2LMNAHTTL3MBTL1
SCHEMBL7583803 0.74 DRD2 (0.39) ALDH1A1USP2LMNAHTTL3MBTL1
SCHEMBL7583792 0.73 DRD2 (0.41) ALDH1A1USP2LMNAHTTL3MBTL1
SCHEMBL18913827 0.73 P2RX7 (0.51) ALDH1A1RAB9AKMT2ATSHRSMN1; SMN2
SCHEMBL18913873 0.73 P2RX7 (0.51) ALDH1A1RAB9AKMT2ATSHRSMN1; SMN2
SCHEMBL7586749 0.71 P2RX7 (0.44) LMNA
Ethane SCHEMBL7588368 0.71 P2RX7 (0.46) ALDH1A1USP2LMNAHTTL3MBTL1
Ethane SCHEMBL7586900 0.71 P2RX7 (0.41) ALDH1A1USP2LMNAHTTL3MBTL1

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
EP-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP claimed