SCHEMBL3922671

SCHEMBL3922671

CCOC(=O)/C(=C/c1cccnc1Cl)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
NFE2L2 Q16236 3/20 0.44
MAPT P10636 5/20 0.44
LMNA P02545 4/20 0.44
CYP2C19 P33261 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 2/20 0.42
NPC1 O15118 1/20 0.42
TDP1 Q9NUW8 3/20 0.39
RAB9A P51151 2/20 0.39
PLIN1 O60240 1/20 0.39
PLIN5 Q00G26 1/20 0.39
ABHD5 Q8WTS1 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL3922678 1.00 KMT2A (0.47) KMT2ANFE2L2MAPTLMNACYP2C19
SCHEMBL1041532 0.76 MAPT (0.46) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL4136416 0.76 MAPT (0.46) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL6934839 0.75 MEN1 (0.57) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL6934835 0.75 MEN1 (0.57) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL7248148 0.75 MEN1 (0.64) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL15084622 0.72 KMT2A (0.55) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL7248152 0.72 MAPT (0.64) KMT2AMAPTLMNACYP2C19MEN1
SCHEMBL3928356 0.72 NFE2L2 (0.49) KMT2ANFE2L2MAPTMEN1NPC1
SCHEMBL4364965 0.72 NFE2L2 (0.46) KMT2ANFE2L2MAPTMEN1NPC1

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-2041122-B1 AZOLYLMETHYLOXIRANES, THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF SE (DE) 2009-11-25 EP disclosed
US-20090203700-A1 Azolylmethyloxiranes, Their Use for Controlling Phytopathogenic Fungi, and Compositions Comprising Them BASF SE (DE) 2009-08-13 US disclosed
WO-2009077497-A2 AZOLYL METHYL OXIRANES, THE USE THEREOF, AND AGENTS CONTAINING THEM BASF SE (DE) 2009-06-25 WO disclosed
EP-2041122-A1 AZOLYLMETHYLOXIRANES, THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF SE (DE) 2009-04-01 EP disclosed
WO-2008003622-A1 AZOLYLMETHYLOXIRANES, THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF SE (DE) 2008-01-10 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-20090203700-A1 Azolylmethyloxiranes, Their Use for Controlling Phytopathogenic Fungi, and Compositions Comprising Them CBR3, NAT1, C5 KMT2A 1226/4885NFE2L2 1164/4885MAPT 3979/4885

“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.