SCHEMBL11490274

SCHEMBL11490274

COC(=O)CCP(=O)(O)OC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 3/20 0.39
CA12 O43570 2/20 0.39
CA14 Q9ULX7 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
RECQL P46063 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL23829725 0.81 TSHR (0.57) TSHRKMT2AMEN1LMNACA12
SCHEMBL2460916 0.81 TSHR (0.61) TSHRKMT2AMEN1LMNACA12
SCHEMBL816663 0.79 TSHR (0.55) TSHRKMT2AMEN1LMNACA12
SCHEMBL2397991 0.79 TSHR (0.55) TSHRKMT2AMEN1LMNACA12
SCHEMBL8622494 0.79 ALDH1A1 (0.41) TSHRKMT2AMEN1LMNAALDH1A1
SCHEMBL11811797 0.78 TSHR (0.60) TSHRKMT2AMEN1LMNACA12
SCHEMBL2984744 0.77 TSHR (0.52) TSHRKMT2AMEN1LMNACA12
SCHEMBL8564916 0.76 POLB (0.44) TSHRKMT2AMEN1LMNACA12
SCHEMBL2990301 0.76 TSHR (0.57) TSHRKMT2AMEN1LMNACA12
SCHEMBL23832898 0.76 MAPK1 (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4045496-A Process for the hydroxylation of phenols and phenol ethers in the nucleus BAYER AKTIENGESELLSCHAFT (DT) 1977-08-30 US claimed
US-4214105-A Process for the hydroxylation of phenol BAYER AKTIENGESELLSCHAFT (DE) 1980-07-22 US disclosed
US-4174460-A Process for the hydroxylation of phenols and phenol ethers in the nucleus BAYER AKTIENGESELLSCHAFT (DE) 1979-11-13 US disclosed
US-4053523-A PROCESS FOR THE HYDROXYLATION OF PHENOL BAYER AKTIENGESELLSCHAFT (DT) 1977-10-11 US disclosed
US-4045496-A Process for the hydroxylation of phenols and phenol ethers in the nucleus BAYER AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed