SCHEMBL7662005

SCHEMBL7662005

Cc1cc(N2CCC(CN3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)CC2)nc(C)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.49
HTR6 P50406 2/20 0.49
LMNA P02545 4/20 0.48
MAPK1 P28482 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
POLB P06746 3/20 0.45
CHRM4 P08173 1/20 0.45
TPSAB1 Q15661 1/20 0.44
ATM Q13315 1/20 0.43
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 1/20 0.43
LSS P48449 3/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 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
SCHEMBL7657257 0.90 LSS (0.52) LMNASMN1; SMN2HTTTPSAB1KDM4E
SCHEMBL7650545 0.82 CNR1 (0.64) LMNASMN1; SMN2NPSR1USP2HTT
SCHEMBL7654703 0.82 HTR7 (0.56) HTR7HTR6LMNANPSR1HTT
SCHEMBL6981479 0.79 CNR1 (0.59) SMN1; SMN2NPSR1USP2HTTLSS
SCHEMBL7660934 0.76 LSS (0.48) LMNASMN1; SMN2TSHRHTTTPSAB1
SCHEMBL7682080 0.73 LSS (0.54) TSHRKDM4ELSSALDH1A1MEN1
SCHEMBL8124161 0.71 F10 (0.69) HTR7HTR6TPSAB1
SCHEMBL6975859 0.69 LSS (0.71) NPSR1TSHRLSSALDH1A1
SCHEMBL3648943 0.69 GPR119 (0.55) KMT2A
SCHEMBL7662786 0.68 LSS (0.53) HTR7HTR6TPSAB1LSSALDH1A1

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-6335341-B1 ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS ZENECA LIMITED (GB) 2002-01-01 US disclosed