SCHEMBL551807

SCHEMBL551807

COCCn1c(=O)[nH]c2c[c]ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 10/20 0.43
GAA P10253 6/20 0.43
KDM4E B2RXH2 6/20 0.43
KMT2A Q03164 6/20 0.43
HPGD P15428 5/20 0.43
GLA P06280 5/20 0.43
HSD17B10 Q99714 5/20 0.43
HTT P42858 2/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 3/20 0.43
POLB P06746 1/20 0.41
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
CYP1A2 P05177 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 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
SCHEMBL10628558 0.81 RAB9A (0.48) RAB9AALDH1A1GAAKDM4EKMT2A
SCHEMBL740232 0.79 RAB9A (0.68) RAB9AALDH1A1KMT2AHPGDHTT
SCHEMBL3781751 0.77 LMNA (0.38) RAB9AALDH1A1KMT2AHPGDHTT
SCHEMBL10169863 0.75 KMT2A (0.55) RAB9AALDH1A1GAAKDM4EKMT2A
SCHEMBL3483288 0.75 LMNA (0.47) GAAKDM4EKMT2AMEN1LMNA
SCHEMBL10138713 0.74 KMT2A (0.51) RAB9AALDH1A1GAAKDM4EKMT2A
SCHEMBL699511 0.74 MEN1 (0.37) ALDH1A1KDM4EKMT2AHPGDHTT
SCHEMBL19705040 0.72 PTGER4 (0.55) RAB9AALDH1A1GAAKDM4EKMT2A
SCHEMBL17845479 0.71 GRIN1 (0.55) RAB9AALDH1A1GAAKDM4EKMT2A
SCHEMBL31121957 0.71 GRIN1 (0.55) RAB9AALDH1A1GAAKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110570-B2 Modulators of acetyl-coenzyme A carboxylase and methods of use thereof CROPSOLUTION, INC. (US) 2012-02-07 US claimed
JP-2011528034-A 2011-11-10 JP claimed
EP-2310015-A1 MODULATORS OF ACETYL-COENZYME A CARBOXYLASE AND METHODS OF USE THEREOF Cropsolution, Inc. (US) 2011-04-20 EP claimed
WO-2010008521-A1 MODULATORS OF ACETYL-COENZYME A CARBOXYLASE AND METHODS OF USE THEREOF CROPSOLUTION, INC. (US) 2010-01-21 WO claimed
US-20100009982-A1 Modulators of Acetyl-Coenzyme A Carboxylase and Methods of Use Thereof CROPSOLUTION, INC. 2010-01-14 US claimed
US-8110570-B2 Modulators of acetyl-coenzyme A carboxylase and methods of use thereof CROPSOLUTION, INC. (US) 2012-02-07 US disclosed
EP-2310015-A1 MODULATORS OF ACETYL-COENZYME A CARBOXYLASE AND METHODS OF USE THEREOF Cropsolution, Inc. (US) 2011-04-20 EP disclosed
WO-2010008521-A1 MODULATORS OF ACETYL-COENZYME A CARBOXYLASE AND METHODS OF USE THEREOF CROPSOLUTION, INC. (US) 2010-01-21 WO disclosed
US-20100009982-A1 Modulators of Acetyl-Coenzyme A Carboxylase and Methods of Use Thereof CROPSOLUTION, INC. 2010-01-14 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 (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-20100009982-A1 Modulators of Acetyl-Coenzyme A Carboxylase and Methods of Use Thereof ACACA, ACAT1, ACACB RAB9A 3632/4885ALDH1A1 476/4885GAA 685/4885

“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.