SCHEMBL4872784

SCHEMBL4872784

CC=C(CCCC)C(=O)OCCO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
MGLL Q99685 1/20 0.44
ATM Q13315 1/20 0.38
TSHR P16473 5/20 0.38
DGKA P23743 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CNR2 P34972 2/20 0.36
TRPV1 Q8NER1 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
DNM1 Q05193 1/20 0.35
CNR1 P21554 1/20 0.35
TP53 P04637 1/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34

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
SCHEMBL22215977 0.89 ACHE (0.46) ACHEATMTSHRALDH1A1HPGD
SCHEMBL998617 0.89 ATM (0.50) ATMTSHRDGKACES2CES1
SCHEMBL28005527 0.87 ACHE (0.43) ACHEMGLLATMTSHRDGKA
SCHEMBL28115131 0.85 TSHR (0.55) ACHEATMTSHRDGKAALDH1A1
SCHEMBL28129101 0.84 ALDH1A1 (0.45) ATMTSHRDGKACES2CES1
SCHEMBL28264170 0.82 FAAH (0.47) ATMTSHRDGKACES2CES1
SCHEMBL997356 0.81 TSHR (0.55) TSHRDGKACES2CES1DNM1
SCHEMBL28010253 0.81 TSHR (0.55) TSHRDGKACES2CES1DNM1
SCHEMBL27737078 0.81 TSHR (0.50) ATMTSHRDGKACES2CES1
SCHEMBL28107615 0.81 TSHR (0.50) ATMTSHRDGKACES2CES1

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
US-7462587-B2 Composition for removing a film from a substrate, a method of removing a film from a substrate, and a method of making the composition GENERAL CHEMICAL CORP (US) 2008-12-09 US disclosed
WO-2005108536-A2 A COMPOSITION FOR REMOVING A FILM FROM A SUBSTRATE, A METHOD OF REMOVING A FILM FROM A SUBSTRATE, AND A METHOD OF MAKING THE COMPOSITION GENERAL CHEMICAL CORPORATION (US) 2005-11-17 WO disclosed
US-20050245412-A1 Composition for removing a film from a substrate, a method of removing a film from a substrate, and a method of making the composition GENERAL CHEMICAL CORPORATION 2005-11-03 US disclosed