SCHEMBL15224082

SCHEMBL15224082

CC(=O)N(C)Cc1ccccc1N(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
GAA P10253 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 2/20 0.47
TP53 P04637 1/20 0.47
APP P05067 1/20 0.41
POLB P06746 1/20 0.41
BRD4 O60885 1/20 0.41
RIPK1 Q13546 1/20 0.41
HSP90AA1 P07900 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
AR P10275 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39

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
SCHEMBL6419274 0.83 MEN1 (0.54) ALDH1A1MAPTSMN1; SMN2POLBRIPK1
SCHEMBL14143465 0.82 RIPK1 (0.45) ALDH1A1MAPTSMN1; SMN2POLBRIPK1
SCHEMBL19400560 0.82 RIPK1 (0.43) ALDH1A1MAPTGAASMN1; SMN2TSHR
SCHEMBL13322844 0.81 AKR1B1 (0.48) ALDH1A1MAPTSMN1; SMN2TSHRPOLB
SCHEMBL13114704 0.81 HSP90AA1 (0.52) ALDH1A1MAPTSMN1; SMN2POLBHSP90AA1
SCHEMBL6415769 0.79 RIPK1 (0.62) ALDH1A1GAASMN1; SMN2RIPK1RAB9A
SCHEMBL6413545 0.79 PYCR1 (0.49) ALDH1A1MAPTSMN1; SMN2TSHRPOLB
SCHEMBL3329126 0.78 GAA (0.48) ALDH1A1MAPTGAASMN1; SMN2TSHR
SCHEMBL15850641 0.77 SLC6A4 (0.48) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL23972323 0.77 CYP1A2 (0.62) POLBTDP1

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-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 US disclosed
US-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-09-28 US disclosed
US-9629924-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2017-04-25 US disclosed
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS BYONDIS B.V. (NL) 2013-08-29 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 (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-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L ALDH1A1 2514/4885MAPT 4526/4885GAA 971/4885
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L ALDH1A1 2514/4885MAPT 4526/4885GAA 971/4885
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS PCNA, DCLRE1A, CDC5L ALDH1A1 2514/4885MAPT 4526/4885GAA 971/4885

“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.