SCHEMBL4641769

SCHEMBL4641769

CCC[CH]C(=O)Oc1ccccc1CC(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
PPARD Q03181 1/20 0.39
TSHR P16473 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.37
TAAR1 Q96RJ0 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
SCHEMBL4643551 0.89 THRA (0.44) THRATHRBL3MBTL1NPSR1PPARD
SCHEMBL4643701 0.82 L3MBTL1 (0.43) THRATHRBL3MBTL1TSHRKDM4E
SCHEMBL28993234 0.81 THRB (0.58) THRATHRBL3MBTL1TSHRKDM4E
SCHEMBL4646795 0.79 POLB (0.45) THRATHRBL3MBTL1TSHRMAPT
SCHEMBL4646605 0.77 KDM4E (0.47) L3MBTL1TSHRCYP1A2KDM4EMAPT
SCHEMBL18050491 0.77 KDM4E (0.53) L3MBTL1TSHRKDM4EMAPTMEN1
SCHEMBL4642134 0.77 SLC6A3 (0.55) L3MBTL1TSHRCYP1A2CYP2C19KDM4E
SCHEMBL4643846 0.76 GAA (0.43) THRATHRBTSHRKDM4EMAPT
SCHEMBL4642260 0.76 L3MBTL1 (0.49) L3MBTL1TSHRKDM4EMAPTMEN1
SCHEMBL4646600 0.76 L3MBTL1 (0.46) L3MBTL1TSHRKDM4EMAPTMEN1

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