SCHEMBL21415970

SCHEMBL21415970

Cc1ccc2c(c1)c1c(n2-c2ccccc2)CCC(C)C/C=C\1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ PTGDR2 Q9Y5Y4 2/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ HTR6 P50406 4/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 3/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ ADRA2A P08913 2/20 0.31
▸ DRD2 P14416 2/20 0.31
▸ HTR2A P28223 2/20 0.31
▸ HTR2C P28335 2/20 0.31
▸ HTR7 P34969 2/20 0.31
▸ ADRA1A P35348 2/20 0.31
▸ HRH1 P35367 2/20 0.31
▸ MAPT P10636 3/20 0.31
▸ LMNA P02545 2/20 0.31
▸ TP53 P04637 2/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL6015428 0.83 FGFR1 (0.35) GAAGFERHTR6KMT2AKDM4E
SCHEMBL20460091 0.78 GAA (0.35) GAAGFERKMT2AKDM4EFGFR1
SCHEMBL20861097 0.78 MAPT (0.34) GAAGFERSIGMAR1HTR6KMT2A
SCHEMBL26186455 0.74 RAB9A (0.34) GAAGFERKMT2AKDM4EMAPT
SCHEMBL20860950 0.74 KDM4E (0.42) GAAGFERSIGMAR1HTR6KMT2A
SCHEMBL22477412 0.73 MAT2A (0.33) GAAPTGDR2KMT2AKDM4EFGFR1
SCHEMBL21913554 0.70 PTGDR2 (0.35) PTGDR2HTR6KMT2AKDM4EADRA2A
SCHEMBL24797463 0.70 KDM4E (0.39) GAASIGMAR1KMT2AKDM4EMAPT
SCHEMBL679015 0.69 KDM4E (0.56) GAAGFERKMT2AKDM4EFGFR1
SCHEMBL12844422 0.68 KMT2A (0.32) GAAKMT2ALMNAALDH1A1HPGD

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
EP-3174885-B1 2,9-FUNCTIONALIZED BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLES AS HOSTS FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) IDEMITSU KOSAN CO (JP) 2019-10-02 — — EP disclosed
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