SCHEMBL7428611

SCHEMBL7428611

CC(=N)NCc1ccccc1C

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HPGD P15428 3/20 0.56
KMT2A Q03164 3/20 0.56
GAA P10253 2/20 0.56
HTT P42858 1/20 0.51
KDM4E B2RXH2 2/20 0.50
LMNA P02545 3/20 0.48
MAPT P10636 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
CHRM2 P08172 1/20 0.47
MEN1 O00255 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PKM P14618 1/20 0.46
CA2 P00918 1/20 0.45

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
SCHEMBL8874118 0.86 ALDH1A1 (0.58) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL4014038 0.82 ALDH1A1 (0.54) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL23317113 0.80 ALDH1A1 (0.56) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL885156 0.80 ALDH1A1 (0.66) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL15928202 0.78 NPC1 (0.61) ALDH1A1HPGDKMT2AHTTLMNA
SCHEMBL24576210 0.78 ALDH1A1 (0.68) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL2017132 0.78 ALDH1A1 (0.73) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL17198747 0.77 KMT2A (0.49) ALDH1A1HPGDKMT2AGAAHTT
SCHEMBL4626308 0.77 KMT2A (0.52) ALDH1A1HPGDKMT2AGAAHTT
Bromide SCHEMBL14895217 0.76 MEN1 (0.54) KMT2AMAPTMEN1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0551330-A4 SUBSTITUTED AMIDINES HAVING HIGH BINDING TO THE SIGMA RECEPTOR AND THE USE THEREOF OREGON STATE (US) 1994-07-06 EP claimed
EP-0551330-A1 SUBSTITUTED AMIDINES HAVING HIGH BINDING TO THE SIGMA RECEPTOR AND THE USE THEREOF The STATE OF OREGON acting by and through the STATE BOARD OF HIGHER EDUCATION on behalf of the UNIV. OF OREGON (US) 1993-07-21 EP claimed
WO-1992004054-A1 SUBSTITUTED AMIDINES HAVING HIGH BINDING TO THE SIGMA RECEPTOR AND THE USE THEREOF STATE OF OREGON, acting by and through THE OREGON STATE BOARD OF HIGHER EDUCATION, acting for and on behalf of THE OREGON HEALTH SCIENCES UNIVERSITY, PORTLAND, OREGON, and THE UNIVERSITY OF OREGON, EUGENE, OREGON, Johnson Hall, University of Oregon (US) 1992-03-19 WO claimed
US-20230348441-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR MEDSHINE DISCOVERY INC. (CN) 2023-11-02 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-20230348441-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR CRBN, CRKL, NCOR1 ALDH1A1 4261/4885HPGD 4408/4885KMT2A 2954/4885

“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.