SCHEMBL2846243

SCHEMBL2846243

C=CCOc1ccc(C(C)(C)C)cc1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
HTT P42858 2/20 0.49
ALDH1A1 P00352 6/20 0.48
NPSR1 Q6W5P4 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 4/20 0.43
TSHR P16473 3/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.42
MAPK1 P28482 3/20 0.42
LMNA P02545 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42

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
SCHEMBL22215853 0.85 ALDH1A1 (0.46) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL12370700 0.84 KMT2A (0.44) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL28268634 0.83 ALOX15 (0.54) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL9638081 0.82 MEN1 (0.43) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL2850836 0.81 SMN1; SMN2 (0.43) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL9491208 0.81 ALDH1A1 (0.47) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL9186644 0.80 MEN1 (0.43) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL3920762 0.80 MAPT (0.54) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL30883282 0.80 ALDH1A1 (0.52) KMT2AMEN1HTTALDH1A1NPSR1
SCHEMBL13259832 0.79 MEN1 (0.48) KMT2AMEN1HTTALDH1A1NPSR1

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-20100204038-A1 Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid CARLONI SILVIA 2010-08-12 US disclosed
EP-1765496-B1 CATALYSTS BASED ON COPPER COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA SPA (IT) 2010-07-14 EP disclosed
US-7723539-B2 Catalysts based on metal complexes for the synthesis of optically active chrysanthemic acid ENDURA S.P.A. (IT) 2010-05-25 US disclosed
US-20080021237-A1 Catalysts Based on Metal Complexes for the Synthesis of Optically Active Chrysanthemic Acid ENDURA S.P.A. (IT) 2008-01-24 US disclosed
EP-1765496-A1 CATALYSTS BASED ON METAL COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA S.p.A. (IT) 2007-03-28 EP disclosed
WO-2005123254-A1 CATALYSTS BASED ON METAL COMPLEXES FOR THE SYNTHESIS OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID ENDURA S.P.A. (IT) 2005-12-29 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-20080021237-A1 Catalysts Based on Metal Complexes for the Synthesis of Optically Active Chrysanthemic Acid SCO2, ME1, ME3 KMT2A 3134/4885MEN1 786/4885HTT 2685/4885

“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.