SCHEMBL8943972

SCHEMBL8943972

CCCCSc1ccc(N(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.48
RYR2 Q92736 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
MAPT P10636 2/20 0.42
HSD17B10 Q99714 1/20 0.42
AR P10275 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CYP1A2 P05177 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
SCHEMBL8944110 0.94 ALDH1A1 (0.46) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL8943559 0.94 RYR2 (0.47) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL423408 0.86 ALDH1A1 (0.51) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL8944217 0.84 CA4 (0.42) ALDH1A1LMNAMEN1KMT2ANPC1
SCHEMBL8943641 0.83 LTA4H (0.58) ALDH1A1LMNASMN1; SMN2MAPTMAOA
SCHEMBL14838080 0.81 PTGES (0.52) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL5170737 0.81 ALDH1A1 (0.61) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL20495338 0.79 PTGES (0.55) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL5315774 0.79 PTGES (0.55) ALDH1A1LMNARYR2MEN1KMT2A
SCHEMBL7260314 0.79 PTGES (0.55) ALDH1A1LMNARYR2MEN1KMT2A

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
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed