SCHEMBL992002

SCHEMBL992002

COc1ccc2c(c1)C(=O)C(Cl)CC2

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.56
CYP19A1 P11511 2/20 0.55
METAP1 P53582 3/20 0.48
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
THRB P10828 1/20 0.46
MAPK1 P28482 1/20 0.46
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
MAOB P27338 1/20 0.44
CYP24A1 Q07973 2/20 0.43
CYP26A1 O43174 1/20 0.43
CYP27A1 Q02318 1/20 0.43

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
SCHEMBL30715530 1.00 ACHE (0.56) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL3587277 0.88 CYP24A1 (0.55) ACHECYP19A1METAP1DRD2DRD3
SCHEMBL5237018 0.83 ACHE (0.71) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL5237012 0.83 ACHE (0.71) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL5237022 0.83 ACHE (0.71) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL13363970 0.81 ACHE (0.56) ACHECYP19A1METAP1DRD2DRD3
SCHEMBL31040171 0.81 CYP19A1 (0.59) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL3875408 0.81 ACHE (0.56) ACHECYP19A1METAP1ALDH1A1CYP3A4
SCHEMBL6630846 0.81 ACHE (0.56) ACHECYP19A1METAP1DRD2DRD3
SCHEMBL30714800 0.81 ACHE (0.56) ACHECYP19A1METAP1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117126126-A Method for asymmetrically synthesizing adjacent halohydrin compound 凯特立斯(深圳)科技有限公司 2023-11-28 CN disclosed
US-8426440-B2 Indolymaleimide derivatives NOVARTIS AG (CH) 2013-04-23 US disclosed
EP-1745037-B1 Indolylmaleimide derivatives as inhibitors for the treatment of graft rejection or autoimmune diseases NOVARTIS AG (CH) 2013-01-02 EP disclosed
EP-2246346-B1 Indolylmaleimide derivatives as protein kinase inhibitors NOVARTIS AG (CH) 2012-10-24 EP disclosed
EP-1904482-B1 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2011-01-19 EP disclosed
EP-2270001-A1 Indolylmaleimide derivatives as PKC inhibitors Novartis AG (CH) 2011-01-05 EP disclosed
EP-2246346-A1 Indolylmaleimide derivatives as protein kinase inhibitors Novartis AG (CH) 2010-11-03 EP disclosed
US-20100273774-A1 INDOLYMALEIMIDE DERIVATIVES WAGNER JUERGEN 2010-10-28 US disclosed
US-7781438-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2010-08-24 US disclosed
US-7648989-B2 Indolylmaleimide derivatives as PKC inhibitors NOVARTIS AG (CH) 2010-01-19 US disclosed
US-20080318975-A1 Indolylmaleimide Derivatives NOVARTIS AG (CH) 2008-12-25 US disclosed
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors NOVARTIS AG (CH) 2008-10-02 US disclosed
EP-1904482-A2 INDOLYLMALEIMIDE DERIVATIVES Novartis AG (CH) 2008-04-02 EP disclosed
EP-1745037-A1 INDOLYLMALEIMIDE DERIVATIVES AS PKC INHIBITORS Novartis AG (CH) 2007-01-24 EP disclosed
WO-2007006533-A2 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2007-01-18 WO disclosed
WO-2005068455-A1 INDOLYLMALEIMDE DERIVATIVES AS PKC INHIBITORS NOVARTIS AG (CH) 2005-07-28 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 (3 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-20100273774-A1 INDOLYMALEIMIDE DERIVATIVES IDO1, INMT, IDO2 ACHE 3083/4885CYP19A1 124/4885METAP1 3924/4885
US-20080242675-A1 Indolylmaleimide Derivatives as Pkc Inhibitors PRKCE, PRKCH, PRKCI ACHE 2009/4885CYP19A1 4288/4885METAP1 1673/4885
US-20080318975-A1 Indolylmaleimide Derivatives IDH3A, INMT, IDH3B ACHE 1598/4885CYP19A1 298/4885METAP1 2559/4885

“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.