SCHEMBL29546367

SCHEMBL29546367

Clc1ccc2nc(-c3ccc(-c4ccccc4)o3)[nH]c2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.71
ALDH1A1 P00352 5/20 0.71
MAPT P10636 4/20 0.71
KDM4E B2RXH2 3/20 0.71
MAPK1 P28482 2/20 0.71
MEN1 O00255 2/20 0.71
TP53 P04637 2/20 0.71
KMT2A Q03164 2/20 0.71
HSD17B10 Q99714 2/20 0.71
CYP3A4 P08684 1/20 0.71
FTO Q9C0B1 1/20 0.71
METAP2 P50579 2/20 0.53
METAP1 P53582 2/20 0.53
CBFB Q13951 1/20 0.53
ADORA3 P0DMS8 1/20 0.51
P2RY6 Q15077 1/20 0.51
NPC1 O15118 3/20 0.50
EGFR P00533 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 2/20 0.48

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
SCHEMBL7038187 0.85 CHEK2 (0.62) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL8337597 0.84 KDM4E (1.00) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL29898236 0.84 KDM4E (1.00) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL11314470 0.82 NPC1 (0.66) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL4185889 0.81 KDM4E (0.94) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL29545706 0.78 CHEK2 (0.64) HPGDALDH1A1MAPTMEN1KMT2A
SCHEMBL18229631 0.76 HDAC6 (0.72)
SCHEMBL4188962 0.75 MEN1 (0.76) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL6831938 0.75 ALDH1A1 (0.48) HPGDALDH1A1MAPTKDM4EMAPK1
SCHEMBL7039869 0.75 CHEK2 (0.53) HPGDALDH1A1MAPTKDM4EMEN1

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
EP-3860994-B1 TRANSCRIPTION FACTOR BRN2 INHIBITORY COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE UNIV BRITISH COLUMBIA (CA) 2024-08-14 EP disclosed
US-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2022-04-07 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-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use BRDT, CBFB, CREBBP HPGD 4220/4885ALDH1A1 3522/4885MAPT 1816/4885

“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.