SCHEMBL6257403

SCHEMBL6257403

NC(=O)c1cccc2nc3ccccc3c(N)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
KDM4E B2RXH2 4/20 0.53
HSD17B10 Q99714 3/20 0.53
GLA P06280 3/20 0.53
HPGD P15428 2/20 0.53
CASP1 P29466 2/20 0.53
CASP7 P55210 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
CHRM2 P08172 1/20 0.53
ADRA2A P08913 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
CHRM1 P11229 1/20 0.53
NQO2 P16083 1/20 0.53
MAOA P21397 1/20 0.53
DRD1 P21728 1/20 0.53
ACHE P22303 1/20 0.53
SLC6A2 P23975 1/20 0.53
ADRA1A P35348 1/20 0.53
OPRM1 P35372 1/20 0.53

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
SCHEMBL11068379 0.83 MAOA (0.52) ALDH1A1KDM4EGLASMN1; SMN2TDP1
SCHEMBL27832433 0.83 PDE10A (0.47) ALDH1A1KDM4EGLAGAAKMT2A
SCHEMBL672454 0.81 CYP1A2 (0.61) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL27935140 0.80 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL13701018 0.76 ALDH1A1 (0.53) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL17066273 0.76 CYP1A2 (0.64) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL28055296 0.76 CYP1A2 (0.55) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL3458914 0.75 ALDH1A1 (0.65) ALDH1A1KDM4EHSD17B10GLAHPGD
SCHEMBL5748273 0.75 KDM4E (0.62) ALDH1A1KDM4EHSD17B10GLAHPGD
Hydrochloric Acid SCHEMBL3242596 0.74 RAB9A (0.67) ALDH1A1KDM4EHSD17B10GLAHPGD

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
EP-1549312-A1 SEQUENTIAL THERAPY COMPRISING A 20(S)-CAMPTOTHECIN AND AN ANTHRACYCLINE SuperGen, Inc. (US) 2005-07-06 EP disclosed
US-20040097437-A1 Sequential therapy comprising a 20(S)-camptothecin and an anthracycline SUPERGEN, INC., A DELAWARE CORPORATION 2004-05-20 US disclosed
WO-2003103672-A1 SEQUENTIAL THERAPY COMPRISING A 20(S)-CAMPTOTHECIN AND AN ANTHRACYCLINE SUPERGEN, INC. (US) 2003-12-18 WO disclosed
US-6627614-B1 Treating a patient having a disease associated with undesirable or uncontrolled cell proliferation. The method comprises: administering to the patient an anthracycline for a period of time during which a 20(S)-camptothecin is not SUPER GEN, INC. 2003-09-30 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-20040097437-A1 Sequential therapy comprising a 20(S)-camptothecin and an anthracycline TOP2A, TOP1, TOP2B ALDH1A1 1398/4885KDM4E 3819/4885HSD17B10 557/4885

“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.