SCHEMBL3085256

SCHEMBL3085256

CCCCC(O)(CO)OC(=O)c1ccc(C(=O)OC(O)(CO)CCCC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
TSHR P16473 4/20 0.42
CYP1A2 P05177 3/20 0.42
ESR1 P03372 3/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 2/20 0.42
MAPK1 P28482 1/20 0.42
NR1H2 P55055 1/20 0.42
RNASEL Q05823 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 1/20 0.41
PDE4D Q08499 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.38
RECQL P46063 1/20 0.38
CHRM1 P11229 1/20 0.38

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
SCHEMBL3085257 0.94 TP53 (0.44) TSHRALDH1A1MAPTKMT2A
SCHEMBL3087840 0.88 SMN1; SMN2 (0.42) CYP1A2CYP2C19SMN1; SMN2CYP2C9ALDH1A1
SCHEMBL3098902 0.83 TP53 (0.43) TSHRALDH1A1MAPTKMT2A
SCHEMBL3087841 0.83 KMT2A (0.43) TSHRSMN1; SMN2KMT2A
SCHEMBL13492201 0.74 LMNA (0.50) LMNATSHRCYP1A2CYP2C19CYP2D6
SCHEMBL8074139 0.73 NPC1 (0.46) LMNATSHRCYP1A2ESR1CYP2C19
SCHEMBL3080380 0.73 KMT2A (0.42) TSHRSMN1; SMN2CYP4A11KMT2A
SCHEMBL1648605 0.73 TSHR (0.43) LMNATSHRCYP1A2ESR1CYP2C19
SCHEMBL29236149 0.72 CYP2D6 (0.50) LMNATSHRCYP1A2CYP2C19CYP2D6
SCHEMBL690293 0.71 ALDH1A1 (0.44) LMNATSHRCYP1A2ESR1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799892-B2 Method of making polybutylene terephthalate and compositions and articles comprising the same SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-09-21 US claimed
US-20090275698-A1 Method of Making Polybutylene Terephthalate and Compositions and Articles Comprising the Same SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2009-11-05 US claimed
US-7799892-B2 Method of making polybutylene terephthalate and compositions and articles comprising the same SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-09-21 US disclosed
US-7799892-B2 Method of making polybutylene terephthalate and compositions and articles comprising the same SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-09-21 US disclosed
US-20090275698-A1 Method of Making Polybutylene Terephthalate and Compositions and Articles Comprising the Same SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2009-11-05 US disclosed
US-20090275698-A1 Method of Making Polybutylene Terephthalate and Compositions and Articles Comprising the Same SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2009-11-05 US disclosed