SCHEMBL2889210

SCHEMBL2889210

CCc1cc(C)cc(C)c1C1C(=O)NC2(CCCCC2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
RAB9A P51151 4/20 0.36
NPC1 O15118 1/20 0.36
PDE7A Q13946 3/20 0.35
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
USP2 O75604 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 2/20 0.31
HSD17B10 Q99714 1/20 0.31
GLA P06280 1/20 0.30
ALOX12 P18054 1/20 0.30
AKR1B1 P15121 1/20 0.30

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
SCHEMBL8652013 0.89 KMT2A (0.40) KMT2ARAB9ANPC1PDE7APOLB
SCHEMBL8645554 0.88 KMT2A (0.38) KMT2ARAB9ANPC1PDE7APOLB
SCHEMBL5437164 0.88 KMT2A (0.38) KMT2ARAB9ANPC1PDE7APOLB
SCHEMBL5107358 0.88 KMT2A (0.35) KMT2ARAB9ANPC1PDE7AMAPT
SCHEMBL3001186 0.85 KMT2A (0.36) KMT2APDE7ASMN1; SMN2LMNA
SCHEMBL2886584 0.84 ACACB (0.33) KMT2A
SCHEMBL1475886 0.84 KMT2A (0.37) KMT2ARAB9ANPC1PDE7APOLB
SCHEMBL3077698 0.81 THRB (0.37) KMT2APDE7AMAPTSMN1; SMN2LMNA
SCHEMBL3176738 0.80 PDE7A (0.35) KMT2ARAB9ANPC1PDE7APOLB
SCHEMBL12496896 0.79 PDE7A (0.40) KMT2ARAB9APDE7APOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7727933-B2 2-ethyl-4,6-dimethyl-phenyl-substituted spirocyclic tetramic acid derivatives BAYER CROPSCIENCE AG (DE) 2010-06-01 US disclosed
US-20070298969-A1 2-Ethyl-4,6-Dimethyl-Phenyl-Substituted Spirocyclic Tetramic Acid Derivatives BAYER CROPSCIENCE AKTIENGESELLSCHAFF (DE) 2007-12-27 US disclosed
EP-1687272-A1 2-ETHYL-4,6-DIMETHYL-PHENYL-SUBSTITUTED SPIROCYCLIC TETRAMIC ACID DERIVATIVES Bayer CropScience AG (DE) 2006-08-09 EP disclosed
WO-2005049569-A1 2-ETHYL-4,6-DIMETHYL-PHENYL-SUBSTITUTED SPIROCYCLIC TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-02 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-20070298969-A1 2-Ethyl-4,6-Dimethyl-Phenyl-Substituted Spirocyclic Tetramic Acid Derivatives DDT, PKD2, CYP2D6 KMT2A 1977/4885RAB9A 1918/4885NPC1 3871/4885

“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.