SCHEMBL9724229

SCHEMBL9724229

CCCCN(CCCC)c1cc(F)cc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.34
NCOA1 Q15788 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CRHR1 P34998 1/20 0.34
NR1H2 P55055 3/20 0.33
NR1H3 Q13133 3/20 0.33
SLC16A3 O15427 1/20 0.33
SLC16A1 P53985 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33

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
SCHEMBL21519517 0.92 DNM1 (0.38) HTTCYP3A4MAPTTRPV1
SCHEMBL19212269 0.92 CYP3A4 (0.39) ARKDM4EALDH1A1POLBGAA
SCHEMBL9724297 0.86 AR (0.35) ARALDH1A1POLBCYP3A4MAPK1
SCHEMBL10689574 0.82 HDAC6 (0.45) ARKDM4EALDH1A1POLBGAA
SCHEMBL18963419 0.78 KDM4E (0.44) ARKDM4EALDH1A1POLBGAA
SCHEMBL9724228 0.77 ALDH1A1 (0.45) KDM4EALDH1A1GAAHTTSMN1; SMN2
SCHEMBL2154654 0.77 DNM1 (0.42) ARCYP3A4SLC16A3SLC16A1
SCHEMBL8664260 0.76 ALDH1A1 (0.45) ARKDM4EALDH1A1POLBGAA
SCHEMBL11934265 0.76 CRHR1 (0.41) ARKDM4EALDH1A1POLBGAA
SCHEMBL10903453 0.75 NPC1 (0.41) ALDH1A1CYP3A4HDAC6

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-5169987-A Light sensitive charge generating compounds for electrography FUJI XEROX CO., LTD. (JP) 1992-12-08 US disclosed
US-5047589-A Electrophotographic light-sensitive material containing squarylium compound FUJI XEROX CO. LTD. (JP) 1991-09-10 US disclosed