SCHEMBL16405357

SCHEMBL16405357

CCCCc1ccc(CCCC[n+]2ccn(CC)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL899200 0.84 ABCB11 (0.45) MEN1KMT2ASMN1; SMN2
SCHEMBL5291584 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL409128 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL962124 0.82 MEN1 (0.47) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL898377 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL5287687 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL5288768 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL5302535 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL899147 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2
SCHEMBL413382 0.82 ABCB11 (0.48) MEN1KMT2ASMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160146996-A1 PHASE DIFFERENCE FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE, AND METHOD OF PRODUCING PHASE DIFFERENCE FILM FUJIFILM CORPORATION (JP) 2016-05-26 US disclosed
US-20150022748-A1 PHASE DIFFERENCE FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE, AND METHOD OF PRODUCING PHASE DIFFERENCE FILM FUJIFILM CORPORATION (JP) 2015-01-22 US disclosed
US-20150022764-A1 PHASE DIFFERENCE FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2015-01-22 US disclosed