SCHEMBL12842016

SCHEMBL12842016

Nc1ccc2[nH]c(C(=O)Nc3ccc4[nH]c(C(=O)N5C[C@@H](CCl)c6c5cc(O)c5ccccc65)cc4c3)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 1/20 0.49
KIT P10721 1/20 0.49
FLT1 P17948 1/20 0.49
FLT4 P35916 1/20 0.49
KDR P35968 1/20 0.49
ABL2 P42684 1/20 0.49
PYGL P06737 8/20 0.43
HDAC2 Q92769 2/20 0.40
KDM1A O60341 1/20 0.38
RCOR1 Q9UKL0 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
NHERF1 O14745 3/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL12733565 0.94 ADH1A (0.48) ADH1AKITFLT1FLT4KDR
SCHEMBL12251618 0.94 ADH1A (0.48) ADH1AKITFLT1FLT4KDR
Seco-Cbi-Indole SCHEMBL29468891 0.93 ADH1A (0.51) ADH1AKITFLT1FLT4KDR
Seco-Cbi-Indole SCHEMBL12596993 0.93 ADH1A (0.51) ADH1AKITFLT1FLT4KDR
SCHEMBL6522948 0.93 ADH1A (0.56) ADH1AKITFLT1FLT4KDR
SCHEMBL5496302 0.93 ADH1A (0.56) ADH1AKITFLT1FLT4KDR
SCHEMBL14301817 0.92 PYGL (0.41) ADH1AKITFLT1FLT4KDR
SCHEMBL13309194 0.92 PYGL (0.41) ADH1AKITFLT1FLT4KDR
SCHEMBL436461 0.91 ADH1A (0.49) ADH1AKITFLT1FLT4KDR
SCHEMBL12508919 0.91 ADH1A (0.49) ADH1AKITFLT1FLT4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250269050-A1 CYCLIC DICHALCOGENIDE ADC LINKER UNITS AND USES THEREOF THORN SESHOLD OLIVER (DE) 2025-08-28 US disclosed
WO-2025078841-A2 ANTIBODIES, CONJUGATES, AND USES THEREOF ANTIKOR BIOPHARMA LIMITED (GB) 2025-04-17 WO disclosed
US-20210369705-A1 COMBINATION THERAPY UTILIZING DNA ALKYLATING AGENTS AND ATR INHIBITORS MERCK PATENT GMBH (DE) 2021-12-02 US disclosed
US-7906545-B2 Prodrugs of CC-1065 analogs IMMUNOGEN INC. (US) 2011-03-15 US disclosed
US-20110008373-A1 PRODRUGS OF CC-1065 ANALOGS IMMUNOGEN, INC. (US) 2011-01-13 US disclosed
US-7655660-B2 Antitumor antibiotic; water solubility, stability; N-[2-{(1-chloromethyl)-1,2-dihydro-5-[(4-methylpiperazino)carbonyloxy]-3H-benz(e)indol-3-yl}carbonyl]-1H-indol-5-yl]-5-[(3-methyldithio-1-oxopropyl)-amino]-1H-indole-2-carboxamide IMMUNOGEN INC. (US) 2010-02-02 US disclosed
US-7655661-B2 Prodrugs of CC-1065 analogs IMMUNOGEN INC. (US) 2010-02-02 US disclosed
US-20090281158-A1 PRODRUGS OF CC-1065 ANALOGS IMMUNOGEN, INC. (US) 2009-11-12 US disclosed
US-20080260685-A1 PRODRUGS OF CC-1065 ANALOGS IMMUNOGEN INC. (US) 2008-10-23 US disclosed
US-20070135346-A1 Prodrugs of CC-1065 analogs IMMUNOGEN INC. 2007-06-14 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 (6 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-20080260685-A1 PRODRUGS OF CC-1065 ANALOGS CASP5, DNPEP, CLSPN ADH1A 3937/4885KIT 3488/4885FLT1 2140/4885
US-20090281158-A1 PRODRUGS OF CC-1065 ANALOGS CASP5, DNPEP, PRCP ADH1A 3929/4885KIT 3409/4885FLT1 2341/4885
US-20210369705-A1 COMBINATION THERAPY UTILIZING DNA ALKYLATING AGENTS AND ATR INHIBITORS ATR, TOP2A, TOP1 ADH1A 3241/4885KIT 2021/4885FLT1 1312/4885
US-20110008373-A1 PRODRUGS OF CC-1065 ANALOGS CASP5, DNPEP, PRCP ADH1A 3929/4885KIT 3409/4885FLT1 2341/4885
US-20250269050-A1 CYCLIC DICHALCOGENIDE ADC LINKER UNITS AND USES THEREOF CCL2, UACA, CAD ADH1A 3820/4885KIT 3435/4885FLT1 2147/4885
US-20070135346-A1 Prodrugs of CC-1065 analogs CASP5, DNPEP, PRCP ADH1A 3929/4885KIT 3409/4885FLT1 2341/4885

“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.