SCHEMBL9718468

SCHEMBL9718468

CN(C)c1ccc(C(=Cc2ccccc2)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.60
RELA Q04206 1/20 0.57
MAPT P10636 6/20 0.56
KMT2A Q03164 6/20 0.56
RAB9A P51151 4/20 0.56
NPC1 O15118 2/20 0.56
CASP3 P42574 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CYP1B1 Q16678 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
ALDH1A1 P00352 6/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 4/20 0.53
HPGD P15428 2/20 0.53
CYP2D6 P10635 1/20 0.53
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL9317348 0.92 ALDH1A1 (0.63) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL16946576 0.87 CYP19A1 (0.72) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL13980016 0.86 ALDH1A1 (0.56) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL13930392 0.85 MAPT (0.50) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL13930398 0.85 MAPT (0.50) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL9006621 0.83 CYP2D6 (0.49) ESR1RELAMAPTKMT2ARAB9A
SCHEMBL12158303 0.81 ALDH1A1 (0.57) ESR1MAPTKMT2ARAB9AALDH1A1
SCHEMBL2487932 0.81 RELA (0.53) RELAMAPTKMT2ARAB9ANPC1
SCHEMBL865422 0.81 ALDH1A1 (0.57) ESR1MAPTKMT2ARAB9AALDH1A1
SCHEMBL13930403 0.81 MAPT (0.58) ESR1MAPTKMT2ARAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110094588-A1 NOVEL ORGANIC DYE AND PREPARATION THEREOF DONGJIN SEMICHEM CO., LTD. (KR) 2011-04-28 US disclosed
US-20110094588-A1 NOVEL ORGANIC DYE AND PREPARATION THEREOF DONGJIN SEMICHEM CO., LTD. (KR) 2011-04-28 US disclosed
US-5080989-A Polycarbonate, solvent resistance EASTMAN KODAK COMPANY (US) 1992-01-14 US disclosed
US-4892949-A ORGANIC PHOTOCONDUCTORS RICOH COMPANY, LTD. (JP) 1990-01-09 US disclosed
US-4859556-A MULTILAYER; ELECTROCONDUCTIVE SUPPORT WITH PHOTOSENSITIVE MATERIAL RICOH COMPANY, LTD. (JP) 1989-08-22 US disclosed
US-4322487-A Composite electrically photosensitive particles for electrophoretic migration imaging process EASTMAN KODAK COMPANY (US) 1982-03-30 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-20110094588-A1 NOVEL ORGANIC DYE AND PREPARATION THEREOF KCNC1, DSP, ODC1 ESR1 2884/4885RELA 1010/4885MAPT 4059/4885

“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.