SCHEMBL23926201

SCHEMBL23926201

CCC(O)CCOC(=O)c1ccc(C(=O)OCCC(O)CC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
ESR1 P03372 3/20 0.53
ALDH1A1 P00352 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
CHRM1 P11229 1/20 0.53
SLC6A2 P23975 1/20 0.53
KDR P35968 1/20 0.53
LMNA P02545 4/20 0.50
CYP1A2 P05177 3/20 0.50
MAPK1 P28482 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2D6 P10635 2/20 0.50
PKM P14618 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NR1H2 P55055 1/20 0.50
RNASEL Q05823 1/20 0.50
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 1/20 0.49
PDE4D Q08499 1/20 0.49

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
SCHEMBL1073073 0.91 LMNA (0.64) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL23926203 0.89 LMNA (0.56) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL13986654 0.89 TAS1R3 (0.47) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL23926221 0.88 LMNA (0.54) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL28545644 0.87 TSHR (0.56) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL23926207 0.84 LMNA (0.58) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL28288106 0.84 LMNA (0.58) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL23855447 0.81 MAPT (0.60) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL3093193 0.81 MAPK1 (0.46) TSHRESR1ALDH1A1TDP1CHRM1
SCHEMBL23926219 0.81 MAPK1 (0.57) TSHRESR1ALDH1A1TDP1CHRM1

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
US-11155675-B2 Method of regioselective synthesis of polyesters from asymmetric diols VERSALIS S.P.A. (IT) 2021-10-26 US disclosed
CN-109689727-B Process for the regioselective synthesis of polyesters from asymmetric diols 维尔萨利斯股份公司 2020-12-01 CN disclosed