SCHEMBL14153340

SCHEMBL14153340

Cn1c2ccc(-c3ccc4c(c3)c3cc5c(cc3n4C)c3cc(-c4cccs4)ccc3n5C)cc2c2cc3c(cc21)c1cc(-c2cccs2)ccc1n3C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ KCNH2 Q12809 1/20 0.45
▸ HTR1D P28221 5/20 0.43
▸ HTR1B P28222 5/20 0.43
▸ MAOA P21397 1/20 0.41
▸ CD38 P28907 1/20 0.41
▸ CHEK1 O14757 1/20 0.40
▸ ERN1 O75460 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39

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
SCHEMBL9979919 0.98 NR4A2 (0.51) NR4A2L3MBTL1KCNH2HTR1DHTR1B
SCHEMBL9979918 0.88 NR4A2 (0.43) NR4A2L3MBTL1KCNH2HTR1DHTR1B
SCHEMBL20987442 0.86 NR4A2 (0.46) NR4A2L3MBTL1CD38CHEK1KDM4E
SCHEMBL15747195 0.82 KDM4E (0.44) NR4A2KDM4EALDH1A1
SCHEMBL12943080 0.79 NR4A2 (0.38) NR4A2L3MBTL1KCNH2HTR1DHTR1B
SCHEMBL14107130 0.77 KDM4E (0.46) NR4A2KDM4EALDH1A1
SCHEMBL20987436 0.76 CNR2 (0.47) NR4A2KDM4EALDH1A1
SCHEMBL28215696 0.76 NR4A2 (0.46) NR4A2KCNH2HTR1DHTR1BKDM4E
SCHEMBL12419782 0.75 GPR3 (0.64) L3MBTL1KDM4ENPC1ALDH1A1RAB9A
SCHEMBL31223938 0.75 NR4A2 (0.46) NR4A2L3MBTL1KCNH2CD38CHEK1

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-7402681-B2 Compound with indolocarbazole moieties and devices containing such compound XEROX CORPORATION (US) 2008-07-22 — — US disclosed
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