SCHEMBL9816664

SCHEMBL9816664

Oc1cccc(Cc2cccc(O)c2Cl)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.56
TSHR P16473 2/20 0.54
HIF1A Q16665 3/20 0.43
HSP90AA1 P07900 2/20 0.43
LMNA P02545 2/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
CYP3A4 P08684 2/20 0.43
MEN1 O00255 1/20 0.43
SLC22A1 O15245 1/20 0.43
USP2 O75604 1/20 0.43
MAPT P10636 1/20 0.43
HSPD1 P10809 1/20 0.43
IDO1 P14902 1/20 0.43
ALOX12 P18054 1/20 0.43
CASP1 P29466 1/20 0.43
HTT P42858 1/20 0.43
BLM P54132 1/20 0.43
HSPE1 P61604 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL3621145 0.85 BCL2 (0.55) HSPA5TSHRHIF1AHSP90AA1HPGD
SCHEMBL286832 0.83 TSHR (0.52) HSPA5TSHRHIF1ALMNAHPGD
SCHEMBL843869 0.81 TSHR (0.50) HSPA5TSHRHIF1ALMNAHPGD
SCHEMBL27588717 0.81 TSHR (0.50) HSPA5TSHRHIF1ALMNAHPGD
Bromide SCHEMBL15942202 0.81 PNMT (0.58) HSPA5TSHRHIF1AIDO1ALDH1A1
SCHEMBL573719 0.81 GABRA1 (0.56) HSPA5TSHRCA1CA2ESR1
SCHEMBL15717687 0.81 TSHR (0.50) HSPA5TSHRHIF1ALMNAHPGD
SCHEMBL69881 0.78
SCHEMBL7494691 0.78 TSHR (0.46) HSPA5TSHRHIF1ALMNAHPGD
SCHEMBL631373 0.78 TSHR (0.46) HSPA5TSHRESR1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0135714-B1 SUSTAINED RELEASE COMPOSITIONS FOR BIOLOGICALLY ACTIVE MATERIALS MELAMINE CHEMICALS, INC. (US) 1991-11-06 EP disclosed