SCHEMBL4641844

SCHEMBL4641844

[CH2]C(=O)OC(=O)C(Cl)(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.55
KCNN4 O15554 1/20 0.41
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
TSHR P16473 2/20 0.38
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 3/20 0.34
CES1 P23141 1/20 0.34
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 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
SCHEMBL4641850 0.81 CYP1A2 (0.55) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL4643825 0.80 CYP1A2 (0.50) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL10725564 0.80 CYP1A2 (0.59) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL4642195 0.80 KCNN4 (0.59) CYP1A2KCNN4TSHRMAPTKMT2A
Ethylene SCHEMBL27527077 0.78 CYP1A2 (0.57) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL27264055 0.78 CYP1A2 (0.61) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL4644723 0.78 CYP1A2 (0.47) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL27468337 0.76 CYP1A2 (0.59) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL2419456 0.76 KCNN4 (0.64) CYP1A2KCNN4CNR1CNR2TSHR
SCHEMBL27383842 0.76 CYP1A2 (0.59) CYP1A2KCNN4CNR1CNR2TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed