SCHEMBL21332779

SCHEMBL21332779

CCc1c(C(=O)N(C)OC)cnn1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
MAPK14 Q16539 1/20 0.43
NR4A3 Q92570 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KMT2A Q03164 2/20 0.41
FPR1 P21462 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 2/20 0.39
NPBWR1 P48145 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL21332821 0.85 KMT2A (0.50) ALDH1A1MAPK14SMN1; SMN2KMT2AFPR1
SCHEMBL21333270 0.82 ALDH1A1 (0.43) ALDH1A1MAPK14SMN1; SMN2KMT2AFPR1
SCHEMBL21332927 0.82 NR4A3 (0.60) ALDH1A1MAPK14NR4A3SMN1; SMN2KMT2A
SCHEMBL21332749 0.81 ALDH1A1 (0.45) ALDH1A1MAPK14SMN1; SMN2KMT2AFPR1
SCHEMBL21333104 0.80 ALDH1A1 (0.51) ALDH1A1MAPK14NR4A3SMN1; SMN2KMT2A
SCHEMBL21333190 0.79 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2KMT2ANPC1LMNA
SCHEMBL370615 0.78 NPBWR1 (0.44) ALDH1A1SMN1; SMN2NPC1LMNANPBWR1
SCHEMBL21333143 0.77 ALDH1A1 (0.48) ALDH1A1MAPK14NR4A3SMN1; SMN2KMT2A
SCHEMBL15130283 0.75 NPBWR1 (0.44) ALDH1A1KMT2ANPC1RAB9AMEN1
SCHEMBL3357317 0.73 NPBWR1 (0.49) ALDH1A1NR4A3NPC1LMNANPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3762377-B1 PYRIDINONE- AND PYRIDAZINONE-BASED COMPOUNDS AND MEDICAL USES THEREOF UNIV CORNELL (US) 2025-08-20 EP disclosed
US-11964960-B2 Pyridinone- and pyridazinone-based compounds and uses thereof CORNELL UNIVERSITY (US) 2024-04-23 US disclosed
EP-3762377-A1 PYRIDINONE- AND PYRIDAZINONE-BASED COMPOUNDS AND MEDICAL USES THEREOF Cook, Timothy, H. (US) 2021-01-13 EP disclosed
US-20200407339-A1 PYRIDINONE- AND PYRIDAZINONE-BASED COMPOUNDS AND USES THEREOF TRI-INSTITUTIONAL THERAPEUTICS DISCOVERY INSTITUTE 2020-12-31 US disclosed
WO-2019173790-A1 PYRIDINONE- AND PYRIDAZINONE-BASED COMPOUNDS AND MEDICAL USES THEREOF HLA TIMOTHY (US) 2019-09-12 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 (2 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-20200407339-A1 PYRIDINONE- AND PYRIDAZINONE-BASED COMPOUNDS AND USES THEREOF PTGER1, LOXL1, COL1A1 ALDH1A1 421/4885MAPK14 2076/4885NR4A3 1388/4885
US-11964960-B2 Pyridinone- and pyridazinone-based compounds and uses thereof PTGER1, LOXL1, COL1A1 ALDH1A1 421/4885MAPK14 2076/4885NR4A3 1388/4885

“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.