SCHEMBL19970640

SCHEMBL19970640

CCOc1cc(C(=O)O)ccc1OCCO

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.72
CASP6 P55212 1/20 0.72
TSHR P16473 1/20 0.69
KDM4E B2RXH2 1/20 0.60
GAA P10253 1/20 0.60
KMT2A Q03164 1/20 0.60
LMNA P02545 1/20 0.57
MAPK1 P28482 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.50
PTPN11 Q06124 1/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49
TPMT P51580 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL19970634 0.92 POLB (0.70) POLBCASP6TSHRKDM4EGAA
SCHEMBL19970628 0.92 POLB (0.70) POLBCASP6TSHRKDM4EGAA
SCHEMBL19970613 0.91 POLB (0.68) POLBCASP6TSHRKDM4EGAA
SCHEMBL19970627 0.91 POLB (0.68) POLBCASP6TSHRKDM4EGAA
SCHEMBL19970629 0.91 POLB (0.68) POLBCASP6TSHRKDM4EGAA
SCHEMBL29882038 0.90 TSHR (0.83) POLBCASP6TSHRKDM4EGAA
SCHEMBL177424 0.90 TSHR (0.83) POLBCASP6TSHRKDM4EGAA
SCHEMBL9426701 0.87 TSHR (0.78) POLBCASP6TSHRKDM4EGAA
SCHEMBL30622549 0.86 TSHR (0.71) POLBCASP6TSHRLMNAMAPK1
SCHEMBL617974 0.86 TSHR (0.71) POLBCASP6TSHRLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351667-B2 Method for producing polyester RIKEN (JP) 2019-07-16 US disclosed
US-20180086879-A1 METHOD FOR PRODUCING POLYESTER RIKEN (JP) 2018-03-29 US disclosed
EP-3296342-A1 METHOD FOR PRODUCING POLYESTER Riken (JP) 2018-03-21 EP disclosed