SCHEMBL10894635

SCHEMBL10894635

CC(C)(C)C(O)CCCCO

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP7 P09237 1/20 0.33
PTGS1 P23219 1/20 0.31
KCNH2 Q12809 1/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 1/20 0.30

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
SCHEMBL28223380 0.97 TSHR (0.42) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL27489612 0.92 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1PTGS1KCNH2
SCHEMBL5127678 0.83 TSHR (0.53) TSHRACACBACACA
SCHEMBL6035330 0.82 SMN1; SMN2 (0.33) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL1050075 0.80
SCHEMBL6570658 0.80
SCHEMBL16074770 0.80 LMNA (0.36) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL16074838 0.80 LMNA (0.36) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL16074900 0.80 LMNA (0.36) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL16074722 0.80 LMNA (0.36) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1073075-C Process for the production of OXO products BOC GROUP INC (US) 2001-10-17 CN disclosed
EP-0090748-B1 STABILIZATION PROCESS FOR POLYVINYL CHLORIDE POLYMERS, STABILIZING COMPOSITIONS FOR CARRYING OUT THE PROCESS AND POLYMERS SO STABILIZED RHONE-POULENC CHIMIE (FR) 1986-11-05 EP disclosed
EP-0090748-A1 Stabilization process for polyvinyl chloride polymers, stabilizing compositions for carrying out the process and polymers so stabilized RHONE-POULENC CHIMIE (FR) 1983-10-05 EP disclosed
EP-0022047-A1 Stabilization process for polymers made of PVC and polymers so stabilized RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1981-01-07 EP disclosed