SCHEMBL9724930

SCHEMBL9724930

CCCCCCCCCC(=O)Oc1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 2/20 0.53
TP53 P04637 1/20 0.53
MGLL Q99685 5/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
CNR1 P21554 2/20 0.49
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
RET P07949 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
RARB P10826 1/20 0.47

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
SCHEMBL8727134 0.95 KMT2A (0.61) KMT2ASMN1; SMN2MAPTTP53HSD17B10
SCHEMBL18087016 0.94 KMT2A (0.62) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL18087026 0.92 KMT2A (0.60) KMT2ASMN1; SMN2MAPTTP53HSD17B10
SCHEMBL7500294 0.89 KMT2A (0.58) KMT2ASMN1; SMN2MAPTTP53HSD17B10
SCHEMBL5696715 0.88 KMT2A (0.68) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL13557797 0.88 KMT2A (0.62) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL18381106 0.88 KMT2A (0.62) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL5696854 0.88 KMT2A (0.68) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL15549028 0.88 KMT2A (0.68) KMT2ASMN1; SMN2MAPTHSD17B10MEN1
SCHEMBL38661498 0.88 KMT2A (0.68) KMT2ASMN1; SMN2MAPTHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5100579-A POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1992-03-31 US disclosed
EP-0191600-B1 POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1991-12-27 EP disclosed
US-4911861-A Mixture of at least two components AJINOMOTO CO., INC. (JP) 1990-03-27 US disclosed
US-4728458-A FERROELECTRIC AJINOMOTO CO., LTD. (JP) 1988-03-01 US disclosed
EP-0191600-A2 Polyphenyl-based ester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1986-08-20 EP disclosed