SCHEMBL31602015

SCHEMBL31602015

CCCCCCC(CC)COCCCCOCCCCO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.56
HTT P42858 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
THRB P10828 1/20 0.52
MAPT P10636 1/20 0.52
USP2 O75604 1/20 0.50
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP14 P50281 1/20 0.47
LMNA P02545 3/20 0.46
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 1/20 0.43
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
PLA2G2C Q5R387 2/20 0.42
SPHK1 Q9NYA1 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL31602022 1.00 CYP3A4 (0.56) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31601969 0.98 CYP3A4 (0.57) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602092 0.98 CYP3A4 (0.57) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602019 0.98 CYP3A4 (0.57) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602086 0.97 CYP3A4 (0.59) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602164 0.93 CYP3A4 (0.56) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602138 0.93 CYP3A4 (0.56) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL5994239 0.93 CYP3A4 (0.59) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL8454803 0.93 CYP3A4 (0.64) CYP3A4HTTMEN1KMT2ATHRB
SCHEMBL31602038 0.93 CYP3A4 (0.59) CYP3A4HTTMEN1KMT2ATHRB

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-120065654-A Aqueous developer composition for flexographic printing plate and method for producing flexographic printing plate 旭化成株式会社 2025-05-30 CN disclosed