SCHEMBL25813103

SCHEMBL25813103

C=C(Cc1ccccc1)C1CCC(C(=O)Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.46
FAAH O00519 1/20 0.46
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
AKR1B1 P15121 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
EPHX2 P34913 1/20 0.42
HTT P42858 1/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
TACR3 P29371 1/20 0.41
HPGD P15428 2/20 0.41
GLA P06280 1/20 0.41
USP2 O75604 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL1155730 0.89 FAAH (0.55) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL12950567 0.89 L3MBTL1 (0.47) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL800064 0.82 EPHX2 (0.56) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL4656202 0.82 ALDH1A1 (0.56) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL163232 0.80 EPHX2 (0.59) L3MBTL1FAAHCES2CES1AKR1B1
SCHEMBL22296135 0.80 ELANE (0.54) L3MBTL1LMNAMEN1KMT2AHTT
SCHEMBL1477277 0.77 GBA1 (0.50) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL4674087 0.77 FAAH (0.47) L3MBTL1LMNAFAAHCES2CES1
SCHEMBL6311476 0.76 LMNA (0.46) L3MBTL1LMNAFAAHCES2CES1
Hydrochloric Acid SCHEMBL9310454 0.76 GBA1 (0.49) L3MBTL1LMNAFAAHCES2CES1

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-3872112-B1 HIGHLY BIO-BASED POLYCARBONATE ESTER AND METHOD FOR PRODUCING SAME SK CHEMICALS CO LTD (KR) 2023-07-19 EP disclosed