SCHEMBL17833711

SCHEMBL17833711

CC(C)c1ccc(N(c2ccc(C3CCCC3)cc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccc(C(C)C)cc5)c5ccc(C6CCCC6)cc5)ccc4c(-c4ccccc4)c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
APP P05067 1/20 0.35
DHODH Q02127 1/20 0.32
PDE2A O00408 2/20 0.31
STAT3 P40763 2/20 0.31
HPGD P15428 1/20 0.31
ROCK2 O75116 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL17833710 0.99 APP (0.37) ALDH1A1APPDHODHPDE2ASTAT3
SCHEMBL17833708 0.95 PDE2A (0.34) APPPDE2A
SCHEMBL17833705 0.89 DHODH (0.36) ALDH1A1DHODHSTAT3
SCHEMBL17833704 0.88 DHODH (0.38) DHODHSTAT3
SCHEMBL17833709 0.87 SMN1; SMN2 (0.34) ALDH1A1DHODHSTAT3
SCHEMBL17833707 0.86 LMNA (0.36) ALDH1A1DHODHSTAT3
SCHEMBL22930198 0.85 DHODH (0.39) DHODHSTAT3
SCHEMBL17833695 0.85 ALDH1A1 (0.38) ALDH1A1DHODHHPGD
SCHEMBL13042626 0.84 APP (0.42) ALDH1A1APPDHODHPDE2ASTAT3
SCHEMBL17833703 0.84 NPC1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210104680-A1 ORGANIC ELECTROLUMINESCENT ELEMINT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2021-04-08 US disclosed
US-10910565-B2 Organic electroluminescent element, material for organic electroluminescent elements, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2021-02-02 US disclosed
US-20160211462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMIRSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed
US-20160211462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMIRSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed
US-20160172602-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed
US-20160172602-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed