SCHEMBL29286807

SCHEMBL29286807

CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCNC

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.64
DNM1 Q05193 4/20 0.44
KDM5A P29375 2/20 0.41
PHF8 Q9UPP1 2/20 0.41
KDM4C Q9H3R0 1/20 0.41
S1PR2 O95136 6/20 0.39
S1PR1 P21453 6/20 0.39
S1PR3 Q99500 6/20 0.39
S1PR5 Q9H228 2/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
ICMT O60725 1/20 0.38
ALB P02768 1/20 0.38
S1PR4 O95977 5/20 0.36
KCNH2 Q12809 1/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL29286833 1.00 EPHX1 (0.64) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL10760746 0.95 EPHX1 (0.71) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL26678000 0.93 EPHX1 (0.54) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL681370 0.90 EPHX1 (0.55) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL13867474 0.88 EPHX1 (0.59) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL21949028 0.86 EPHX1 (0.56) EPHX1DNM1KDM5APHF8KDM4C
SCHEMBL10811942 0.85 EPHX1 (0.48) EPHX1TSHRHSD17B10
SCHEMBL21501557 0.85 EPHX1 (0.48) EPHX1TSHRHSD17B10
SCHEMBL13867483 0.85 EPHX1 (0.46) EPHX1KDM4C
SCHEMBL15569827 0.84 PRMT3 (0.45) EPHX1KDM4C

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
CN-113301965-A Hair care system, hair care method and use of hair care system 欧莱雅 2021-08-24 CN disclosed