SCHEMBL2484545

SCHEMBL2484545

Cc1nsnc1C(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
MAPT P10636 4/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SRD5A2 P31213 1/20 0.41
HPGD P15428 2/20 0.41
PLA2G1B P04054 1/20 0.41
MAPK1 P28482 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ADORA2A P29274 1/20 0.40

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
SCHEMBL15372850 0.76 ALDH1A1 (0.43) ALDH1A1MAPTLMNAHTTKMT2A
SCHEMBL28349946 0.73 ALDH1A1 (0.50) ALDH1A1MAPTHTTKMT2AMEN1
SCHEMBL11177962 0.70 HTT (0.58) ALDH1A1MAPTLMNAHTTKMT2A
SCHEMBL8009609 0.70 ALDH1A1 (0.53) ALDH1A1MAPTLMNAHTTKMT2A
SCHEMBL6587237 0.70 PKM (0.50) ALDH1A1MAPTLMNAHTTKMT2A
SCHEMBL3891217 0.69 GRM5 (0.50) ALDH1A1MAPTLMNAHTTKMT2A
Dimethylamine SCHEMBL10372614 0.68 ALDH1A1 (0.46) ALDH1A1MAPTHTTKMT2AMEN1
Benzophenone SCHEMBL7454682 0.67 ALDH1A1 (0.88) ALDH1A1MAPTLMNAKMT2AMEN1
Benzophenone SCHEMBL30536983 0.67 ALDH1A1 (1.00) ALDH1A1MAPTLMNAKMT2AMEN1
Benzophenone SCHEMBL28491203 0.67 ALDH1A1 (1.00) ALDH1A1MAPTLMNAKMT2AMEN1

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
US-8580799-B2 Fungicide hydroximoyl-heterocycles derivatives BAYER CROPSCIENCE AG (DE) 2013-11-12 US disclosed
US-20110294829-A1 FUNGICIDE HYDROXIMOYL-HETEROCYCLES DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
EP-2376464-A1 FUNGICIDE HYDROXIMOYL-HETEROCYCLES DERIVATIVES Bayer CropScience Aktiengesellschaft (DE) 2011-10-19 EP disclosed
WO-2010066697-A1 FUNGICIDE HYDROXIMOYL-HETEROCYCLES DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-06-17 WO 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-20110294829-A1 FUNGICIDE HYDROXIMOYL-HETEROCYCLES DERIVATIVES HAAO, HPD, HAO1 ALDH1A1 1606/4885MAPT 3696/4885LMNA 1273/4885

“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.