SCHEMBL20180466

SCHEMBL20180466

CNCC(C)(C)NC(=O)c1ccc(N)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.49
POLB P06746 2/20 0.47
ESRRG P62508 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
HIF1A Q16665 1/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
LMNA P02545 4/20 0.46
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
APEX1 P27695 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SLC22A2 O15244 1/20 0.43
SLC22A1 O15245 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
ACHE P22303 1/20 0.43
MAPK1 P28482 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
SCHEMBL11074386 0.84 NPC1 (0.52) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL5940572 0.84 HTT (0.52) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL688944 0.83 POLB (0.70) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL854187 0.80 LMNA (0.53) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL4023884 0.78 PHLPP2 (0.48) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL688943 0.78 MAPT (0.47) EPHX2POLBESRRGKDM4EMAPT
Tert-Butylamine SCHEMBL7372525 0.77 LMNA (0.50) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL21335533 0.76 MAPT (0.49) EPHX2POLBESRRGMAPTLMNA
SCHEMBL13270520 0.75 JAK2 (0.57) EPHX2POLBESRRGKDM4EMAPT
SCHEMBL22987120 0.75 MAPT (0.49) EPHX2POLBESRRGKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10603387-B2 Duocarmycin ADCs showing improved in vivo antitumor activity SYNTHON BIOPHARMACEUTICALS B.V. (NL) 2020-03-31 US disclosed
US-20180140711-A1 DUOCARMYCIN ADCS SHOWING IMPROVED IN VIVO ANTITUMOR ACTIVITY SYNTHON BIOPHARMACEUTICALS B.V. (NL) 2018-05-24 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 (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-20180140711-A1 DUOCARMYCIN ADCS SHOWING IMPROVED IN VIVO ANTITUMOR ACTIVITY CD38, BRCA1, TP53 EPHX2 4522/4885POLB 2848/4885ESRRG 2639/4885
US-10603387-B2 Duocarmycin ADCs showing improved in vivo antitumor activity CD38, BRCA1, TP53 EPHX2 4522/4885POLB 2848/4885ESRRG 2639/4885

“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.