SCHEMBL16704418

SCHEMBL16704418

CCCCCCCCc1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3ccc(N(c4ccccc4)c4cccc(-c5ccc6c(c5)CC6)c4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.42
▸ RARB P10826 8/20 0.42
▸ RARA P10276 2/20 0.42
▸ RARG P13631 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ STAT3 P40763 3/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CTSV O60911 1/20 0.39
▸ CTSL P07711 1/20 0.39
▸ MLNR O43193 1/20 0.38
▸ LTB4R2 Q9NPC1 1/20 0.38

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
SCHEMBL12620168 1.00 HSD11B1 (0.42) HSD11B1RARBRARARARGMEN1
SCHEMBL12900184 0.86 CTSV (0.35) HSD11B1RARBRARARARGSTAT3
SCHEMBL19320304 0.84 MLNR (0.39) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL19078588 0.84 MLNR (0.50) HSD11B1ALDH1A1KCNH2HSD17B10MLNR
SCHEMBL26082937 0.83 HSD17B3 (0.40) ALDH1A1MAPT
SCHEMBL18472736 0.83 MLNR (0.43) RARBRARARARGMEN1ALDH1A1
SCHEMBL14063940 0.82 RARB (0.57) HSD11B1RARBRARARARGMEN1
SCHEMBL15076231 0.82 HSD11B1 (0.58) HSD11B1RARBRARAMEN1ALDH1A1
SCHEMBL16153687 0.81 MMP2 (0.34) LTB4R2
SCHEMBL16406677 0.81 MMP2 (0.34) LTB4R2

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
US-9028980-B2 Organic electroluminescent element, composition for organic electroluminescent element, and organic electroluminescent device MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-12 — — US disclosed
Send feedback