SCHEMBL11543742

SCHEMBL11543742

CNC(C)CCCCCCCCCCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
FFAR4 Q5NUL3 2/20 0.50
FFAR1 O14842 2/20 0.50
LMNA P02545 1/20 0.50
NFKB1 P19838 1/20 0.50
PMP22 Q01453 1/20 0.50
ALDH1A1 P00352 3/20 0.48
KDM4C Q9H3R0 2/20 0.47
KDM4A O75164 1/20 0.47
PHF8 Q9UPP1 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
GSTK1 Q9Y2Q3 1/20 0.47
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
GPR84 Q9NQS5 5/20 0.46
HDAC11 Q96DB2 5/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46

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
Hydrochloric Acid SCHEMBL9230401 0.96 LMNA (0.46) TSHRFFAR4FFAR1LMNANFKB1
SCHEMBL6267662 0.91 ENPEP (0.45) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL23323311 0.82
SCHEMBL6254876 0.82
Octanedioate SCHEMBL27681728 0.80 TSHR (0.57) TSHRFFAR4FFAR1LMNANFKB1
SCHEMBL1831446 0.80 TSHR (0.57) TSHRFFAR4FFAR1LMNANFKB1
SCHEMBL27662220 0.80 TSHR (0.57) TSHRFFAR4FFAR1LMNANFKB1
Pimelic Acid SCHEMBL27662196 0.80 TSHR (0.57) TSHRFFAR4FFAR1LMNANFKB1
Sebacic Acid SCHEMBL27681751 0.80 TSHR (0.57) TSHRFFAR4FFAR1LMNANFKB1
Hydrochloric Acid SCHEMBL27811441 0.80 ANPEP (0.52) ALDH1A1KDM4CKDM4AKDM2A

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
US-4165329-A CARBOXYLATED UREA METAL SALTS CHEVRON RESEARCH COMPANY (US) 1979-08-21 US disclosed