SCHEMBL4064497

SCHEMBL4064497

Cc1nc2c(cc1Br)ncn2COCC[Si](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.41
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
KLKB1 P03952 1/20 0.31
PNP P00491 2/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
EDNRA P25101 1/20 0.30
HTR2A P28223 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
HBB P68871 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL20552062 0.84 BRD4 (0.39) DGAT1BRD4CREBBPPNPUSP2
SCHEMBL20551665 0.80 BRD4 (0.37) DGAT1BRD4CREBBPPNPUSP2
SCHEMBL189854 0.79 BRD4 (0.46) DGAT1BRD4CREBBPHSD17B10
SCHEMBL24344409 0.78 MEN1 (0.45) DGAT1BRD4CREBBPUSP2MEN1
SCHEMBL19203911 0.78 DGAT1 (0.41) DGAT1KLKB1
SCHEMBL15118602 0.78 BRD4 (0.39) DGAT1BRD4CREBBPPNPUSP2
SCHEMBL19538828 0.77 BRD4 (0.46) DGAT1BRD4CREBBPMEN1KMT2A
SCHEMBL15509087 0.76 MEN1 (0.51) USP2TSHRHSD17B10MEN1KMT2A
SCHEMBL20553727 0.76 BRD4 (0.34) DGAT1BRD4CREBBP
SCHEMBL23101058 0.76 BRD4 (0.34) DGAT1BRD4CREBBP

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
EP-2909212-B1 SUBSTITUTED 1,4-DIHYDROPYRAZOLO[4,3-B]INDOLES TAKEDA PHARMACEUTICALS CO (JP) 2017-02-22 EP disclosed
US-9475816-B2 Substituted-1,4-dihydropyrazolo[4,3-b]indoles TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-10-25 US disclosed
US-20150225405-A1 SUBSTITUTED-1,4-DIHYDROPYRAZOLO[4,3-b]INDOLES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-08-13 US disclosed
US-20090306126-A1 Indole Derivatives ASTRAZENECA AB (SE) 2009-12-10 US disclosed
EP-2029593-A1 INDOLE DERIVATIVES AstraZeneca AB (SE) 2009-03-04 EP disclosed
WO-2007135398-A1 INDOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-11-29 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 (2 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-20150225405-A1 SUBSTITUTED-1,4-DIHYDROPYRAZOLO[4,3-b]INDOLES GPR119, RPLP2, FOXM1 DGAT1 1917/4885BRD4 527/4885CREBBP 1140/4885
US-20090306126-A1 Indole Derivatives MTOR, IDO1, AKT1S1 DGAT1 3242/4885BRD4 1263/4885CREBBP 1649/4885

“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.