SCHEMBL7871343

SCHEMBL7871343

Cc1cccc(N(c2ccccc2)c2ccc(CCCCCCO)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
BCHE P06276 2/20 0.42
SIGMAR1 Q99720 3/20 0.40
LPAR1 Q92633 1/20 0.39
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
ALDH1A1 P00352 3/20 0.39
PAX8 Q06710 2/20 0.39
JAK2 O60674 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
STAT3 P40763 1/20 0.38
PLK1 P53350 1/20 0.38
TP53 P04637 1/20 0.38
GPX4 P36969 1/20 0.38
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL7877465 0.88 TDP1 (0.46) KMT2AMEN1LPAR1RAB9ANPC1
SCHEMBL7871374 0.86 SIGMAR1 (0.40) KMT2AMEN1SIGMAR1LPAR1RAB9A
SCHEMBL15788734 0.82 RAB9A (0.44) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL21758048 0.82 MEN1 (0.54) KMT2AMEN1BCHESIGMAR1ALDH1A1
SCHEMBL13989151 0.82 CA1 (0.43) BCHERAB9ANPC1ALDH1A1PAX8
SCHEMBL17324352 0.82 RAB9A (0.44) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL18214664 0.82 IGF1R (0.47) KMT2AMEN1BCHEALDH1A1TP53
SCHEMBL2771243 0.82 HSD11B1 (0.48) KMT2AMEN1BCHELPAR1RAB9A
SCHEMBL7871388 0.81 GPR52 (0.38) KMT2AMEN1BCHESIGMAR1LPAR1
SCHEMBL7874939 0.81 ALDH1A1 (0.44) KMT2AMEN1RAB9ANPC1ALDH1A1

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-20010017155-A1 Of monovinylated triarylamine monomers; use in light emitting diodes or as components of photorefractive materials CALIFORNIA INSTITUTE OF TECHNOLOGY 2001-08-30 US disclosed