SCHEMBL5006946

SCHEMBL5006946

CCC(C)(C)c1cc(Cc2ccccc2)cc(C(C)(C)CC)c1O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
IDH1 O75874 1/20 0.42
PTPN1 P18031 3/20 0.41
PTPN2 P17706 1/20 0.41
PTPN6 P29350 1/20 0.41
CALM1 P0DP23 1/20 0.41
BCL2 P10415 1/20 0.40
BCL2L1 Q07817 1/20 0.40
SLC22A2 O15244 1/20 0.40
HSPA5 P11021 1/20 0.38
LMNA P02545 1/20 0.37
HNF4A P41235 1/20 0.37

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
SCHEMBL11797622 0.89 HSPA5 (0.44) MEN1GAAKMT2AHSPA5LMNA
SCHEMBL9442177 0.87 TRPA1 (0.39) MEN1GAAKMT2AIDH1PTPN1
SCHEMBL9652548 0.87 PTPN1 (0.58) PTPN1PTPN2PTPN6LMNAHNF4A
SCHEMBL1187217 0.84 MEN1 (0.57) MEN1GAAKMT2AIDH1PTPN1
SCHEMBL9442181 0.83 CNR2 (0.46) MEN1GAAKMT2APTPN1PTPN2
SCHEMBL3678528 0.81 NPC1 (0.41) IDH1PTPN1PTPN2PTPN6LMNA
SCHEMBL11347393 0.81 HSPA5 (0.50) MEN1GAAKMT2APTPN1PTPN2
SCHEMBL28117868 0.80 ALDH1A1 (0.51) MEN1GAAKMT2APTPN1BCL2
Diethyl Sulfide SCHEMBL28247409 0.79 MEN1 (0.49) MEN1GAAKMT2ABCL2BCL2L1
SCHEMBL4915927 0.79 SHBG (0.47) MEN1GAAKMT2AHSPA5LMNA

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
US-20080014515-A1 Organic photoreceptor and electrophotographic image forming apparatus including the organic photoreceptor SAMSUNG ELECTRONICS CO., LTD. 2008-01-17 US disclosed
EP-1879074-A2 Organic photoreceptor and electrophotographic image forming apparatus including the photoreceptor Samsung Electronics Co., Ltd. (KR) 2008-01-16 EP disclosed
EP-1879073-A2 Organic photoreceptor and electrophotographic image forming apparatus including the organic photoreceptor Samsung Electronics Co., Ltd. (KR) 2008-01-16 EP disclosed
US-5236979-A Containing synergistic mixture of tris/hydroxybenzyl/benzene and bis/alkylphenyl/pentaerythritol diphosphite ECP ENICHEM POLIMERI S.R.L. (IT) 1993-08-17 US disclosed