SCHEMBL19624099

SCHEMBL19624099

CCC(C=C(C)C)/C=C\CCCCS

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 4/20 0.32
CYP2D6 P10635 3/20 0.32
MAPK1 P28482 3/20 0.32
TP53 P04637 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
GMNN O75496 2/20 0.30
LMNA P02545 2/20 0.30
GLA P06280 2/20 0.30
POLB P06746 2/20 0.30
THRB P10828 2/20 0.30
CETP P11597 2/20 0.30
CXCR5 P32302 2/20 0.30
CCR6 P51684 2/20 0.30
BLM P54132 2/20 0.30
UBE2N P61088 2/20 0.30

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
SCHEMBL7804858 0.79 MEN1 (0.32) MEN1KMT2ACYP3A4
SCHEMBL1305538 0.71 MEN1 (0.50) MEN1KMT2ACYP3A4MAPTCYP2D6
SCHEMBL1305535 0.71 MEN1 (0.50) MEN1KMT2ACYP3A4MAPTCYP2D6
SCHEMBL11965178 0.62 SPHK2 (0.49) MEN1KMT2AMAPTCYP2D6MAPK1
SCHEMBL10897479 0.62 ABCG2 (0.49) MEN1KMT2ACYP3A4MAPTCYP2D6
SCHEMBL10897482 0.62 ABCG2 (0.49) MEN1KMT2ACYP3A4MAPTCYP2D6
SCHEMBL9666758 0.61 FAAH (0.52) MEN1KMT2ACYP3A4MAPTTP53
SCHEMBL815577 0.61 FAAH (0.58) MEN1KMT2ACYP3A4MAPTTP53
SCHEMBL21313309 0.61 ALDH1A1 (0.45) MEN1KMT2ACYP3A4MAPTCYP1A2
SCHEMBL11081575 0.61 FAAH (0.58) MEN1KMT2ACYP3A4MAPTTP53

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
EP-3246305-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-11-22 EP disclosed