SCHEMBL10169863

SCHEMBL10169863

COCCn1c(=O)[nH]c2cc(C)ccc21

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
RAB9A P51151 2/20 0.55
DAO P14920 2/20 0.53
ALDH1A1 P00352 9/20 0.47
KDM4E B2RXH2 5/20 0.47
GLA P06280 5/20 0.47
GAA P10253 5/20 0.47
HPGD P15428 4/20 0.47
HSD17B10 Q99714 4/20 0.47
PKM P14618 2/20 0.47
HTT P42858 1/20 0.47
GRIN1 Q05586 1/20 0.45
GRIN2B Q13224 1/20 0.45
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CALCRL Q16602 1/20 0.41

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
SCHEMBL10138713 0.84 KMT2A (0.51) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL11705078 0.82 DAO (0.55) KMT2AMEN1RAB9ADAOALDH1A1
SCHEMBL6059727 0.82 DAO (0.59) KMT2AMEN1RAB9ADAOALDH1A1
SCHEMBL19705040 0.82 PTGER4 (0.55) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL740232 0.80 RAB9A (0.68) KMT2AMEN1RAB9AALDH1A1HPGD
SCHEMBL10085576 0.80 ALDH1A1 (0.57) KMT2ARAB9AALDH1A1KDM4EGLA
SCHEMBL10139723 0.80 KMT2A (0.47) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL10139260 0.80 SIRT2 (0.51) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL14326956 0.80 KMT2A (0.62) KMT2AMEN1RAB9ADAOALDH1A1
SCHEMBL14906562 0.79 DAO (0.53) KMT2AMEN1RAB9ADAOALDH1A1

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-8110570-B2 Modulators of acetyl-coenzyme A carboxylase and methods of use thereof CROPSOLUTION, INC. (US) 2012-02-07 US disclosed
US-8110570-B2 Modulators of acetyl-coenzyme A carboxylase and methods of use thereof CROPSOLUTION, INC. (US) 2012-02-07 US disclosed
US-20100009982-A1 Modulators of Acetyl-Coenzyme A Carboxylase and Methods of Use Thereof CROPSOLUTION, INC. 2010-01-14 US 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 KMT2A 1889/4885MEN1 952/4885RAB9A 3632/4885

“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.