SCHEMBL22605887

SCHEMBL22605887

CCCCCCCCN1C(=O)c2ccc3c4ncc5c6c(ccc(c7ncc(c2c37)C1=O)c64)C(=O)N(CCO)C5=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ RGS12 O14924 2/20 0.51
▸ HTT P42858 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PABPC1 P11940 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ STAT3 P40763 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ TERT O14746 5/20 0.41
▸ HEXA P06865 1/20 0.40
▸ HEXB P07686 1/20 0.40
▸ DYRK3 O43781 1/20 0.39
▸ RPS6KB1 P23443 1/20 0.39
▸ EPHA2 P29317 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
SCHEMBL20964322 0.94 STAT3 (0.47) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL22746164 0.88 KDM4E (0.48) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL24603682 0.84 TDP1 (0.47) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL24017161 0.83 MEN1 (0.38) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL27071534 0.83 CYP1B1 (0.47) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL26198042 0.83 CDC25A (0.46) ALDH1A1CES1CDC25A
SCHEMBL24017089 0.82 PTGS1 (0.47) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL20964344 0.80 PTGS1 (0.45) MEN1KMT2ARGS12HTTKDM4E
SCHEMBL24603662 0.79 ASAH1 (0.34) MEN1KMT2ARGS12HTTNPC1
SCHEMBL24017084 0.79 MGLL (0.41) MEN1KMT2ARGS12HTTKDM4E

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
US-11011706-B2 Organic semiconductor element, organic semiconductor composition, organic semiconductor film, method of manufacturing organic semiconductor film, and polymer using the same FUJIFILM CORPORATION (JP) 2021-05-18 — — US disclosed
US-20200343451-A1 ORGANIC SEMICONDUCTOR ELEMENT, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR FILM, AND POLYMER USING THE SAME FUJIFILM CORPORATION (JP) 2020-10-29 — — US disclosed
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