SCHEMBL5877667

SCHEMBL5877667

CC(C)Cc1cc(O)cc(OCC2CO2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TP53 P04637 3/20 0.44
TSHR P16473 3/20 0.44
HIF1A Q16665 2/20 0.44
CYP3A4 P08684 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
PPARG P37231 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
PKM P14618 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
CHRNB4 P30926 3/20 0.36
CHRNA3 P32297 3/20 0.36
GLA P06280 1/20 0.36
CNR1 P21554 6/20 0.34

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
SCHEMBL5877663 0.84 TSHR (0.36) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL867770 0.81 ALDH1A1 (0.63) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL28451464 0.81 ALDH1A1 (0.58) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL732286 0.81 TSHR (0.47) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL4365824 0.77 ALDH1A1 (0.57) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL24510901 0.75 ALDH1A1 (0.51) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL5848630 0.74 ALDH1A1 (0.50) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL2655500 0.74 CNR1 (0.47) CNR1CNR2
SCHEMBL6903461 0.73 ALDH1A1 (0.50) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL20821162 0.73 CALM1 (0.56) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7064157-B2 Epoxy resin modified with a side chain having a reactive phosphorus-containing compound, e.g., 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide CHANG CHUN PLASTICS CO., LTD. (TW) 2006-06-20 US disclosed
US-20020032279-A1 Flame retardant resin and flame retardant composition containing the same CHANG CHUN PLASTICS CO., LTD. 2002-03-14 US disclosed