SCHEMBL7587486

SCHEMBL7587486

Cc1ccc(S[CH]Cc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
LMNA P02545 3/20 0.44
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
ACHE P22303 2/20 0.42
BCHE P06276 1/20 0.42
MAOB P27338 1/20 0.41
HTT P42858 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ATM Q13315 1/20 0.39
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL223718 0.86 MAOB (0.50) MAPTLMNAALDH1A1NPSR1MAOB
SCHEMBL13707146 0.76 MAPT (0.44) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL3380070 0.74 MAOA (0.58) MAPTALDH1A1NPSR1KMT2AMEN1
SCHEMBL1740014 0.73 TDP1 (0.38) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL9770101 0.73 LMNA (0.50) MAPTLMNAALDH1A1NPSR1ACHE
SCHEMBL5645870 0.70 MAOB (0.52) ALDH1A1MAOBTSHRKDM4E
SCHEMBL3851412 0.69 MAPT (0.47) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL1987774 0.69 MAOB (0.46) MAPTLMNAALDH1A1NPSR1ACHE
SCHEMBL17752846 0.69 ACHE (0.53) MAPTLMNAALDH1A1KMT2AMEN1
SCHEMBL1709979 0.68 RAB9A (0.60) MAPTLMNAALDH1A1KMT2AMEN1

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-0844269-B1 BLOCK COPOLYMER HAVING FUNCTIONAL GROUPS AT BOTH ENDS KATAOKA KAZUNORI (JP) 2002-10-23 EP disclosed
US-5929177-A LIVING POLYMER WITH HYDROPHILIC, HYDROPHOBIC SEGMENTS Kataoka, Kazunori (JP) 1999-07-27 US disclosed
EP-0844269-A1 BLOCK POLYMER HAVING FUNCTIONAL GROUPS AT BOTH ENDS Kataoka, Kazunori (JP) 1998-05-27 EP disclosed