SCHEMBL3765877

SCHEMBL3765877

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
SLC22A6 Q4U2R8 2/20 0.36
PLA2G10 O15496 1/20 0.36
TSHR P16473 5/20 0.35
HDAC11 Q96DB2 4/20 0.35
KMT2A Q03164 2/20 0.35
GABRR3 A8MPY1 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
HDAC3 O15379 1/20 0.35
GABBR2 O75899 1/20 0.35
CYP1A2 P05177 1/20 0.35
THRB P10828 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRR1 P24046 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRR2 P28476 1/20 0.35
SLC6A1 P30531 1/20 0.35

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
SCHEMBL4514142 0.93 TSHR (0.41) LMNASLC22A6PLA2G10TSHRHDAC11
SCHEMBL136592 0.80 LMNA (0.42) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL7866598 0.79 AKR1B1 (0.45) SLC22A6TSHRHDAC11KMT2AAKR1B1
SCHEMBL812764 0.79 LMNA (0.40) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL15281992 0.76 FFAR4 (0.53) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL29124599 0.75 CYP1A2 (0.40) SLC22A6TSHRHDAC11KMT2ACYP1A2
SCHEMBL434144 0.74 LMNA (0.36) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL14809951 0.73 TSHR (0.48) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL14809356 0.73 TSHR (0.48) LMNASLC22A6TSHRHDAC11KMT2A
SCHEMBL2504161 0.73 TSHR (0.48) LMNASLC22A6TSHRHDAC11KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064082-B1 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CO (US) 2004-06-02 EP claimed
US-8207098-B2 Lubricant additive, lubricant composition and grease composition YAMANASHI UNIVERSITY (JP) 2012-06-26 US disclosed
WO-2007018394-A9 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2010-12-02 WO disclosed
US-20090239773-A1 LUBRICANT ADDITIVE, LUBRICANT COMPOSITION AND GREASE COMPOSITION YAMANASHI UNIVERSITY (JP) 2009-09-24 US disclosed
EP-1913081-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG Chem. Ltd. (KR) 2008-04-23 EP disclosed
WO-2007018394-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2007-02-15 WO disclosed
US-20070037929-A1 Highly elastic polyvinyl chloride composition and products prepared using the same LG CHEM, LTD (KR) 2007-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090239773-A1 LUBRICANT ADDITIVE, LUBRICANT COMPOSITION AND GREASE COMPOSITION GRN, GRIA1, GRIK5 LMNA 3546/4885SLC22A6 2953/4885PLA2G10 143/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.