SCHEMBL9623317

SCHEMBL9623317

Oc1ccccc1C(CCCCCCCCCC(c1ccccc1O)c1ccccc1O)c1ccccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
POLB P06746 2/20 0.43
HPGD P15428 3/20 0.40
ALOX15 P16050 2/20 0.39
CA12 O43570 2/20 0.39
CA2 P00918 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
GMNN O75496 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EGFR P00533 1/20 0.39
LMNA P02545 1/20 0.39
FYN P06241 1/20 0.39
CA3 P07451 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
MMP9 P14780 1/20 0.39
NFKB1 P19838 1/20 0.39

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
SCHEMBL9623303 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623485 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623306 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9622726 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623579 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623718 1.00 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9838259 0.98 TSHR (0.50) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL4316171 0.93 TSHR (0.50) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL20520222 0.90 TSHR (0.50) TSHRGABRA1GABRB2ALDH1A1MAPT
SCHEMBL20520238 0.90 TSHR (0.50) TSHRGABRA1GABRB2ALDH1A1MAPT

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-5134204-A Polymaleimide, Polyepoxide, Phenolic Compound MITSUI TOATSU CHEMICALS, INC. (JP) 1992-07-28 US disclosed
EP-0397395-A2 Resin composition for sealing semiconductors MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-11-14 EP disclosed
EP-0397396-A2 Resin composition for sealing semiconductors MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-11-14 EP disclosed