SCHEMBL4198601

SCHEMBL4198601

CC(N)Nc1ccc(NC(C)N)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
RAB9A P51151 5/20 0.46
MAPK1 P28482 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
EGFR P00533 1/20 0.46
PABPC1 P11940 1/20 0.46
MAOA P21397 5/20 0.45
ADORA2A P29274 3/20 0.45
FGR P09769 1/20 0.45
PIM1 P11309 1/20 0.45
CSNK1A1 P48729 1/20 0.45
CSNK1D P48730 1/20 0.45
DYRK1A Q13627 1/20 0.45
HIPK2 Q9H2X6 1/20 0.45
CSNK1G1 Q9HCP0 1/20 0.45
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
POLB P06746 3/20 0.44

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
SCHEMBL4193002 0.88 THRB (0.33) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL30102545 0.87 MAPT (0.64) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL30102541 0.87 MAPT (0.64) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL30039621 0.84 MEN1 (0.52) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL92040 0.84 MEN1 (0.52) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL29351322 0.84 MEN1 (0.52) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL8788976 0.80 MAOA (0.47) MAPTMAPK1SMN1; SMN2MAOAMEN1
SCHEMBL3910548 0.79 ADORA2A (0.63) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL15158287 0.78 MEN1 (0.45) MAPTRAB9AMAPK1SMN1; SMN2TDP1
SCHEMBL29721704 0.78 MAPT (0.61) MAPTRAB9AMAPK1SMN1; SMN2TDP1

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-8420861-B2 Anti-tumor compounds derived from 1,4,5,8-tetrachloroanthraquinone ISHMAEL D RICHARD (US) 2013-04-16 US disclosed
US-20090156807-A1 Anti-tumor Compounds Derived From 1,4,5,8-tetrachloroanthraquinone ISHMAEL D RICHARD 2009-06-18 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 (1 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-20090156807-A1 Anti-tumor Compounds Derived From 1,4,5,8-tetrachloroanthraquinone CASP4, CASP8, CASP1 MAPT 4707/4885RAB9A 2022/4885MAPK1 802/4885

“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.