SCHEMBL23533348

SCHEMBL23533348

CCCCCC1CCC(C=C(C)C(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
PKM P14618 1/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 2/20 0.40
CYP1A2 P05177 3/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LSS P48449 2/20 0.38
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
ALOX5 P09917 1/20 0.36
CCR2 P41597 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33

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
SCHEMBL23533347 1.00 TP53 (0.42) TP53PKMMAPTMEN1KMT2A
SCHEMBL820463 0.95 MAPT (0.45) TP53PKMMAPTMEN1KMT2A
SCHEMBL7799123 0.95 MAPT (0.45) TP53PKMMAPTMEN1KMT2A
SCHEMBL1051357 0.81 ALDH1A1 (0.33)
SCHEMBL1051355 0.81 ALDH1A1 (0.33)
SCHEMBL10842643 0.80 CYP1A2 (0.41) TP53PKMMAPTMEN1KMT2A
SCHEMBL10842640 0.80 CYP1A2 (0.41) TP53PKMMAPTMEN1KMT2A
SCHEMBL1581726 0.79 GMNN (0.31) CYP1A2CYP2D6CYP2C9CYP2C19POLB
Bicarbonate SCHEMBL11329202 0.78 MAPT (0.53) TP53PKMMAPTMEN1KMT2A
SCHEMBL5606971 0.78 ALDH1A1 (0.40)

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
WO-2021125327-A1 METHOD FOR MANUFACTURING PATTERNED LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2021-06-24 WO disclosed