SCHEMBL7745652

SCHEMBL7745652

C=C(C)C(=O)OCCCCCCCCCC.C=CC(=O)NC(C)(C)C.C=CC(=O)NCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 3/20 0.56
TSHR P16473 2/20 0.56
ZDHHC2 Q9UIJ5 2/20 0.56
ACHE P22303 11/20 0.40
EPHX2 P34913 2/20 0.38
EPHX1 P07099 1/20 0.37
FAAH O00519 1/20 0.37

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
SCHEMBL7564908 0.96 ZDHHC20 (0.51) ZDHHC20TSHRZDHHC2ACHEEPHX2
SCHEMBL17347983 0.86 TSHR (0.56) ZDHHC20TSHRZDHHC2ACHE
SCHEMBL18855009 0.86 TSHR (0.56) ZDHHC20TSHRZDHHC2ACHE
SCHEMBL17347982 0.85 TSHR (0.53) ZDHHC20TSHRZDHHC2ACHE
Methacrylic Acid SCHEMBL7795521 0.84 ZDHHC20 (0.53) ZDHHC20TSHRZDHHC2EPHX2EPHX1
SCHEMBL22382274 0.82 ZDHHC20 (0.69) ZDHHC20TSHRZDHHC2EPHX1FAAH
Hydrochloric Acid SCHEMBL31290726 0.82 TSHR (0.57) ZDHHC20TSHRZDHHC2ACHE
SCHEMBL2857335 0.82 ZDHHC20 (0.48) ZDHHC20TSHRZDHHC2ACHEEPHX1
SCHEMBL28455265 0.81 TSHR (0.67) ZDHHC20TSHRZDHHC2ACHEEPHX1
SCHEMBL17345313 0.81 TSHR (0.50) ZDHHC20TSHRZDHHC2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1068387-A2 MODIFIED TEXTILE AND OTHER MATERIALS AND METHODS FOR THEIR PREPARATION Avantgarb LLC (US) 2001-01-17 EP disclosed
WO-1999049124-A2 MODIFIED TEXTILE AND OTHER MATERIALS AND METHODS FOR THEIR PREPARATION AVANTGARB, LLC (US) 1999-09-30 WO disclosed