SCHEMBL2150100

SCHEMBL2150100

Cc1ccc(Nc2ccc(-c3ccccc3)c(-c3ccccc3)c2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.46
MAPT P10636 4/20 0.45
RAB9A P51151 3/20 0.43
GAA P10253 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
ALOX12 P18054 1/20 0.42
HDAC7 Q8WUI4 1/20 0.41
LMNA P02545 3/20 0.40
NPC1 O15118 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
DHODH Q02127 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 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
SCHEMBL606273 0.89 MAPT (0.45) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL23875735 0.87 MAPT (0.44) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL30477867 0.83 MAPT (0.52) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL10019438 0.83 MAPT (0.52) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL13580077 0.83 MAPT (0.52) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL12388896 0.83 MAPT (0.52) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL9006076 0.82 MAPK14 (0.44) MAPTRAB9AGAASMN1; SMN2ALDH1A1
SCHEMBL606274 0.82 MAPT (0.40) RAPGEF4MAPTRAB9AGAASMN1; SMN2
SCHEMBL1655412 0.81 CNR2 (0.46)
SCHEMBL3718540 0.80 HPGD (0.59) MAPTRAB9AGAASMN1; SMN2ALDH1A1

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-20110186834-A1 NOVEL 1,3,5-TRIS(DIARYLAMINO)BENZENE AND USE THEREOF BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2011-08-04 US disclosed
EP-2341043-A1 NOVEL 1,3,5-TRIS(DIARYLAMINO)BENZENE AND USE THEREOF Bando Chemical Industries, Ltd. (JP) 2011-07-06 EP 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-20110186834-A1 NOVEL 1,3,5-TRIS(DIARYLAMINO)BENZENE AND USE THEREOF CBR1, CYP1B1, CBR3 RAPGEF4 4195/4885MAPT 4623/4885RAB9A 2377/4885

“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.