SCHEMBL2950313

SCHEMBL2950313

CCCCN(CCCC)c1ccc(N(c2ccc(N(CCCC)CCCC)cc2)c2ccc(N(CCCC)CCCC)cc2OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 2/20 0.48
SLC16A1 P53985 2/20 0.48
NR1H2 P55055 5/20 0.41
NR1H3 Q13133 5/20 0.41
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
AR P10275 1/20 0.36
NR1I2 O75469 1/20 0.36
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL11939407 0.81 SLC16A3 (0.50) SLC16A3SLC16A1NR1H2NR1H3ALDH1A1
SCHEMBL12304301 0.80 SLC16A3 (0.44) SLC16A3SLC16A1ALDH1A1L3MBTL1
SCHEMBL2950543 0.79 CRHR1 (0.42) NR1H2NR1H3ALDH1A1KDM4EPOLB
SCHEMBL19496111 0.78 SLC16A3 (0.48) SLC16A3SLC16A1NR1H2NR1H3ALDH1A1
SCHEMBL1573445 0.78 CNR2 (0.47) SLC16A3SLC16A1ALDH1A1GAANR1I2
SCHEMBL2954673 0.78 NR1H2 (0.43) NR1H2NR1H3ALDH1A1KDM4EPOLB
SCHEMBL16248320 0.78 SLC16A3 (0.47) SLC16A3SLC16A1NR1H2NR1H3ALDH1A1
SCHEMBL1577124 0.78 SLC16A3 (0.52) SLC16A3SLC16A1ALDH1A1L3MBTL1MEN1
SCHEMBL23350318 0.77 SLC16A3 (0.47) SLC16A3SLC16A1NR1H2NR1H3ALDH1A1
SCHEMBL23350317 0.77 SLC16A3 (0.50) SLC16A3SLC16A1NR1H2NR1H3ALDH1A1

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-7759504-B2 Diimmonium compound having perchlorate ion or hexafluorophosphate ion as counter ion with sufficient heat resistance and solubility; photopolymerization initiator and electrophotographic photoreceptor FUJIFILM CORPORATION (JP) 2010-07-20 US disclosed
US-20080255387-A1 TRIARYLAMINE DERIVATIVE FUJIFILM CORPORATION (JP) 2008-10-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080255387-A1 TRIARYLAMINE DERIVATIVE METTL14, MYH14, TOMM22 SLC16A3 3418/4885SLC16A1 3292/4885NR1H2 911/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.