SCHEMBL25336232

SCHEMBL25336232

COc1cccc2nc(C)cc(CCCC(F)(F)F)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
ELANE P08246 2/20 0.41
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
NQO2 P16083 4/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
G6PD P11413 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
DCPS Q96C86 1/20 0.39
TSHR P16473 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL25338671 0.86 ELANE (0.43) KDM4EALDH1A1HPGDELANENQO2
SCHEMBL25339154 0.83 KDM4E (0.38) KDM4EHSP90AA1HSP90AB1MAPTRAB9A
SCHEMBL25338208 0.82 L3MBTL1 (0.36) KDM4EALDH1A1HPGDHSP90AA1HSP90AB1
SCHEMBL29443533 0.81 HSP90AA1 (0.40) HSP90AA1HSP90AB1CYP1A2CYP2D6CYP2C19
SCHEMBL25339454 0.81 HSP90AA1 (0.40) HSP90AA1HSP90AB1CYP1A2CYP2D6CYP2C19
SCHEMBL25336273 0.79 DCPS (0.43) KDM4EALDH1A1HPGDELANEHSP90AA1
SCHEMBL25338806 0.79 ELANE (0.42) KDM4EALDH1A1HPGDELANEHSP90AA1
SCHEMBL25337677 0.77 ALOX5 (0.41) KDM4EELANELMNASMN1; SMN2NR3C1
SCHEMBL25338337 0.77 DCPS (0.41) KDM4EALDH1A1HPGDELANEHSP90AA1
SCHEMBL25338834 0.75 ELANE (0.44) KDM4EALDH1A1HPGDELANENQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240032541-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-02-01 US disclosed
EP-4210489-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2023-07-19 EP disclosed
WO-2022053422-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-03-17 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-20240032541-A1 HERBICIDAL COMPOUNDS HAX1, DDT, MTX1 KDM4E 1954/4885ALDH1A1 264/4885HPGD 2391/4885

“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.