SCHEMBL8098613

SCHEMBL8098613

NC1=CCC(N)(Cl)C=C1c1ccco1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 4/20 0.35
BLM P54132 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 3/20 0.33
POLB P06746 3/20 0.32
MEN1 O00255 2/20 0.32
PKM P14618 2/20 0.32
ALOX15 P16050 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
PTPN7 P35236 1/20 0.32

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
SCHEMBL7805939 0.81 TAAR1 (0.36) TAAR1MAPTALDH1A1BLMKDM4E
SCHEMBL8099925 0.69 CDK5 (0.30) CDK5CDK5R1
SCHEMBL8099970 0.68 KDM4E (0.32) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL8071786 0.66
SCHEMBL1799678 0.59 ALDH1A1 (0.63) TAAR1MAPTALDH1A1BLMKDM4E
SCHEMBL7805947 0.57 CHRM2 (0.34) TAAR1MAPTALDH1A1BLMKDM4E
SCHEMBL9801815 0.55
SCHEMBL2965728 0.54 KDM4E (0.36) TAAR1MAPTALDH1A1BLMKDM4E
SCHEMBL28466834 0.54 LPL (0.37) TAAR1MAPTALDH1A1BLMKDM4E
SCHEMBL13369992 0.54 TAAR1 (0.41) TAAR1MAPTALDH1A1BLMKDM4E

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-6042620-A FOR DYEING KERATIN FIBERS SUCH AS HAIR WELLA AG (DE) 2000-03-28 US disclosed