SCHEMBL21691033

SCHEMBL21691033

O=C(Cn1cnc(Cl)c1Cl)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 1.00
SMN1; SMN2 Q16637 4/20 0.55
EGFR P00533 1/20 0.51
RAB9A P51151 6/20 0.50
KMT2A Q03164 2/20 0.50
STAT1 P42224 1/20 0.50
HPGD P15428 2/20 0.48
MAPK1 P28482 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
P2RX7 Q99572 1/20 0.48
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 3/20 0.47
HTT P42858 1/20 0.47
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.44
SLC12A2 P55011 1/20 0.44
SLC12A5 Q9H2X9 1/20 0.44
MGAM O43451 1/20 0.44

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
SCHEMBL12985063 0.79 POLB (0.65) POLBP2RX7ALDH1A1MAPT
SCHEMBL10247528 0.79 POLB (0.65) POLBKMT2AL3MBTL1ALDH1A1MEN1
Hydrochloric Acid SCHEMBL1775311 0.78 POLB (0.63) POLBKMT2AL3MBTL1ALDH1A1MEN1
SCHEMBL12537294 0.76 P2RX7 (0.66) POLBSMN1; SMN2EGFRRAB9AKMT2A
SCHEMBL18825270 0.74 CA12 (0.71) POLBSMN1; SMN2RAB9AL3MBTL1NPC1
SCHEMBL9795163 0.72 POLB (0.56) POLBSMN1; SMN2EGFRRAB9AKMT2A
SCHEMBL15722800 0.72 POLB (0.56) POLBSMN1; SMN2MAPK1HTTGAA
SCHEMBL11044807 0.71 POLB (0.55) POLBSMN1; SMN2KMT2AMAPK1L3MBTL1
SCHEMBL10733533 0.71 POLB (0.55) POLBSMN1; SMN2EGFRRAB9AKMT2A
SCHEMBL9795418 0.69 POLB (0.52) POLBSMN1; SMN2EGFRRAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12114658-B2 Compounds having a nitrogen-containing unsaturated six-membered ring and agricultural and horticultural fungicides containing the same as active ingredients MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2024-10-15 US disclosed
EP-3828177-B1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT MITSUI CHEMICALS CROP & LIFE SOLUTIONS INC (JP) 2023-11-29 EP disclosed
EP-3828177-B1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT MITSUI CHEMICALS CROP & LIFE SOLUTIONS INC (JP) 2023-11-29 EP disclosed
EP-3828177-A1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2021-06-02 EP disclosed
EP-3828177-A1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2021-06-02 EP disclosed
WO-2020022412-A1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT 三井化学アグロ株式会社 2020-01-30 WO disclosed
WO-2020022412-A1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT 三井化学アグロ株式会社 2020-01-30 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-12114658-B2 Compounds having a nitrogen-containing unsaturated six-membered ring and agricultural and horticultural fungicides containing the same as active ingredients CYP51A1, NOS1, ERG28 POLB 4802/4885SMN1; SMN2 3212/4885EGFR 2999/4885

“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.