SCHEMBL8772490

SCHEMBL8772490

CCCCCC(N)c1ccccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
IKBKB O14920 1/20 0.45
CSNK1E P49674 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
SLC2A1 P11166 1/20 0.41
PPARG P37231 2/20 0.38
SLC37A4 O43826 1/20 0.38
OPRM1 P35372 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
NAAA Q02083 1/20 0.37
CA2 P00918 1/20 0.37
POLB P06746 1/20 0.37
CNR2 P34972 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.36

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
SCHEMBL22444739 0.98 TSHR (0.47) TSHRIKBKBCSNK1EGABRA1GABRB2
SCHEMBL22444478 0.98 TSHR (0.47) TSHRIKBKBCSNK1EGABRA1GABRB2
SCHEMBL11809865 0.98 TSHR (0.47) TSHRIKBKBCSNK1EGABRA1GABRB2
SCHEMBL5792353 0.95 TSHR (0.50) TSHRIKBKBCSNK1EGABRA1GABRB2
SCHEMBL940014 0.87 TSHR (0.53) TSHRIKBKBCSNK1EGABRA1GABRB2
Hydrochloric Acid SCHEMBL326013 0.85 TSHR (0.52) TSHRIKBKBCSNK1EGABRA1GABRB2
SCHEMBL30714953 0.85 TSHR (0.52) TSHRCSNK1EGABRA1GABRB2PPARG
SCHEMBL6690451 0.85 TSHR (0.52) TSHRCSNK1EGABRA1GABRB2PPARG
SCHEMBL22444751 0.84 TSHR (0.50) TSHRCSNK1EGABRA1GABRB2PPARG
SCHEMBL22444754 0.84 TSHR (0.50) TSHRCSNK1EGABRA1GABRB2PPARG

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-113574041-B Bisphenol production method and polycarbonate resin production method 三菱化学株式会社 2023-10-13 CN disclosed
CN-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed
EP-0799200-A1 SUBSTITUTED AZETIDIN-2-ONES FOR TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-10-08 EP disclosed