SCHEMBL22691982

SCHEMBL22691982

Cc1cc(C(=O)OCc2ccccc2C)c(C)cc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
KDM4E B2RXH2 5/20 0.49
MAPT P10636 4/20 0.49
MAOB P27338 2/20 0.49
ADORA2A P29274 1/20 0.49
HSD17B10 Q99714 2/20 0.45
HPGD P15428 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 1/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL24455161 0.84 ALDH1A1 (0.54) ALDH1A1MAPTHSD17B10HPGDNPC1
SCHEMBL30498658 0.84 ALDH1A1 (0.54) ALDH1A1MAPTHSD17B10HPGDNPC1
SCHEMBL6574035 0.80 ALDH1A1 (0.60) ALDH1A1KDM4EHSD17B10HPGDNPC1
SCHEMBL9578209 0.80 L3MBTL1 (0.58) ALDH1A1KDM4EMAPTMAOBADORA2A
SCHEMBL6671600 0.78 RAB9A (0.48) ALDH1A1KDM4EMAPTMAOBADORA2A
SCHEMBL22692020 0.78 L3MBTL1 (0.47) ALDH1A1KDM4EMAPTMAOBADORA2A
SCHEMBL30481767 0.78 SHBG (0.55) ALDH1A1KDM4EMAPTMAOBHPGD
SCHEMBL24459529 0.78 SHBG (0.55) ALDH1A1KDM4EMAPTMAOBHPGD
SCHEMBL27833418 0.76 TDP1 (0.61) ALDH1A1KDM4EMAPTMAOBADORA2A
SCHEMBL22692035 0.76 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTMAOBADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220220068-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2022-07-14 US disclosed
US-20220220068-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2022-07-14 US disclosed
EP-3972414-A1 FUNGICIDAL ARYL AMIDINES Corteva Agriscience LLC (US) 2022-03-30 EP disclosed
CN-113613494-A Fungicidal arylamidines 科迪华农业科技有限责任公司 2021-11-05 CN disclosed
WO-2020237131-A1 FUNGICIDAL ARYL AMIDINES DOW AGROSCIENCES LLC (US) 2020-11-26 WO disclosed
WO-2020237131-A1 FUNGICIDAL ARYL AMIDINES DOW AGROSCIENCES LLC (US) 2020-11-26 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-20220220068-A1 FUNGICIDAL ARYL AMIDINES CYP1A1, CYP1A2, CYP1B1 ALDH1A1 105/4885KDM4E 648/4885MAPT 4011/4885

“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.