SCHEMBL25552201

SCHEMBL25552201

CO/C=C(/C(=O)OC)c1cccc(C)c1CO/N=C(\C)c1cccc(C)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.39
NPC1 O15118 6/20 0.37
RAB9A P51151 6/20 0.37
KCNK3 O14649 2/20 0.37
KCNK9 Q9NPC2 2/20 0.37
LMNA P02545 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARG P37231 2/20 0.34
PPARA Q07869 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL23969503 0.88 KMT2A (0.42) HIF1AMEN1KMT2APPARGPPARA
SCHEMBL25552199 0.87 HIF1A (0.48) HIF1ANPC1RAB9AKCNK3KCNK9
SCHEMBL23977993 0.85 HIF1A (0.41) HIF1ANPC1RAB9AKCNK3KCNK9
SCHEMBL23971878 0.84 HIF1A (0.54) HIF1ANPC1RAB9AKCNK3KCNK9
SCHEMBL23971691 0.83 S1PR1 (0.34) HIF1ASMN1; SMN2
SCHEMBL25551838 0.83 KCNK3 (0.38) NPC1RAB9AKCNK3KCNK9LMNA
SCHEMBL25600089 0.82 S1PR1 (0.31) SMN1; SMN2
SCHEMBL25720601 0.81 HIF1A (0.32) HIF1ANPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL31711599 0.81 NPC1 (0.36) HIF1ANPC1RAB9AKCNK3KCNK9
SCHEMBL31711609 0.81 NPC1 (0.36) HIF1ANPC1RAB9AKCNK3KCNK9

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-20230172207-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS I BASF SE (DE) 2023-06-08 US disclosed
US-20230172204-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS III BASF SE (DE) 2023-06-08 US disclosed
US-20230172205-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS IV BASF SE (DE) 2023-06-08 US 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 (3 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-20230172204-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS III COX5B, SQOR, UQCRB HIF1A 2044/4885NPC1 1501/4885RAB9A 401/4885
US-20230172207-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS I COX5B, SQOR, UQCRB HIF1A 1889/4885NPC1 1332/4885RAB9A 439/4885
US-20230172205-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS IV COX5B, SQOR, COX5A HIF1A 2001/4885NPC1 1456/4885RAB9A 442/4885

“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.