SCHEMBL1846121

SCHEMBL1846121

N#Cc1cc(Br)cnc1NCC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.44
PIP4K2A P48426 1/20 0.38
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
TBK1 Q9UHD2 2/20 0.35
EGFR P00533 3/20 0.34
MELK Q14680 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KDR P35968 1/20 0.33
PIK3CA P42336 1/20 0.33
PRKCI P41743 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CCNA1 P78396 1/20 0.32

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
SCHEMBL19328130 0.79 PGK1 (0.44) GLAMEN1KMT2AEGFRSMN1; SMN2
SCHEMBL29477047 0.78 CCNA2 (0.48) GLAMEN1GAAKMT2AEGFR
SCHEMBL19328092 0.75 SMN1; SMN2 (0.47) GLAGAAEGFRSMN1; SMN2MAPT
SCHEMBL4099333 0.75 DYRK1A (0.41) GLAEGFRSMN1; SMN2MAPTPKM
SCHEMBL1848870 0.74 NPC1 (0.48) GAASMN1; SMN2KDM4EPOLBHPGD
SCHEMBL21117070 0.74 KDM4E (0.42) GAAEGFRSMN1; SMN2MAPTKDM4E
SCHEMBL974622 0.74 PIP4K2A (0.39) PIP4K2AMEN1GAAKMT2ATBK1
SCHEMBL16990326 0.73 MAPT (0.37) GLAGAASMN1; SMN2MAPTPOLB
SCHEMBL31350832 0.72 CHEK1 (0.37) GLAMEN1KMT2ATBK1EGFR
SCHEMBL17591608 0.72 EGFR (0.37) TBK1EGFRSMN1; SMN2KDRMAPT

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-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-12-24 US disclosed
US-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-12-24 US disclosed
US-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-12-24 US disclosed
EP-2324024-B1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH INC (US) 2012-09-26 EP disclosed
US-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE ARGENTA DISCOVERY 2009 LIMITED (GB) 2011-05-26 US disclosed
US-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE ARGENTA DISCOVERY 2009 LIMITED (GB) 2011-05-26 US disclosed
US-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE ARGENTA DISCOVERY 2009 LIMITED (GB) 2011-05-26 US disclosed
EP-2324024-A1 DIAZACARBAZOLES AND METHODS OF USE Genentech, Inc. (US) 2011-05-25 EP disclosed
WO-2009151589-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2009-12-17 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-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B GLA 2606/4885PIP4K2A 558/4885MEN1 1132/4885
US-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B GLA 2606/4885PIP4K2A 558/4885MEN1 1132/4885

“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.