SCHEMBL9804432

SCHEMBL9804432

CCc1cc(O)cc(CC)c1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.48
BCL2L1 Q07817 1/20 0.48
ALOX5 P09917 1/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
IDH1 O75874 2/20 0.45
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HSD17B3 P37058 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
TP53 P04637 1/20 0.43
PTPN1 P18031 2/20 0.41
PTPN2 P17706 1/20 0.41
PTPN6 P29350 1/20 0.41
NQO1 P15559 1/20 0.41
CALM1 P0DP23 1/20 0.41
MEN1 O00255 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL11682273 0.82 TYR (0.46) BCL2BCL2L1ALOX5KDM4ENPSR1
SCHEMBL11680476 0.80 GABRA1 (0.44) BCL2BCL2L1ALOX5KDM4EALDH1A1
SCHEMBL5250861 0.79 TP53 (0.50) BCL2BCL2L1IDH1TP53CALM1
SCHEMBL11589520 0.76 THRA (0.49) BCL2BCL2L1ALOX5KDM4EALDH1A1
SCHEMBL10601277 0.76 TP53 (0.46) BCL2BCL2L1ALDH1A1TP53CALM1
SCHEMBL6158092 0.76 HSP90AA1 (0.50) BCL2BCL2L1ALOX5IDH1TP53
SCHEMBL278266 0.75 ALOX5 (0.59) BCL2BCL2L1ALOX5KDM4EALDH1A1
SCHEMBL11247242 0.74 TP53 (0.40) BCL2BCL2L1KDM4EALDH1A1MAPT
SCHEMBL11247239 0.74 IDH1 (0.41) BCL2BCL2L1KDM4EALDH1A1IDH1
SCHEMBL5439911 0.74 PTPN1 (0.41) ALOX5PTPN1MEN1CYP3A4ALOX15

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
EP-0186255-B1 PROCESS FOR PREPARING BENZYL SUBSTITUTED PHENOLS, DIBENZYLPHENOLIC COMPOUNDS, AND THE ANTIOXIDANT USE OF SUCH PHENOLS ETHYL CORPORATION (US) 1991-04-10 EP disclosed
EP-0186255-A2 Process for preparing benzyl substituted phenols, dibenzylphenolic compounds, and the antioxidant use of such phenols ETHYL CORPORATION (US) 1986-07-02 EP disclosed