SCHEMBL15435896

SCHEMBL15435896

C1=Cc2nc3cc4ccccc4cc3cc2CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.35
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL409559 0.86 ALDH1A1 (0.43) NQO2ALDH1A1GLAMAPTHPGD
Hydrochloric Acid SCHEMBL8134377 0.85 ALDH1A1 (0.42) NQO2ALDH1A1GLAMAPTHPGD
Hydrochloric Acid SCHEMBL30274776 0.85 ALDH1A1 (0.42) NQO2ALDH1A1GLAMAPTHPGD
SCHEMBL29827623 0.80 ALDH1A1 (0.34) ALDH1A1
SCHEMBL28593235 0.75 KMT2A (0.41) NQO2ALDH1A1GLAMAPTHPGD
SCHEMBL5904470 0.73 PARP1 (0.35) ALDH1A1ACHEMEN1KMT2A
SCHEMBL5330437 0.73 NQO2 (0.33) NQO2MEN1KMT2A
Anthracene SCHEMBL27804282 0.73 MEN1 (0.36) ALDH1A1MEN1KMT2A
SCHEMBL686691 0.72 MEN1 (0.35) ALDH1A1MEN1KMT2A
SCHEMBL17220622 0.72 MEN1 (0.35) ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2877455-B1 FUSED QUINONIC COMPOUNDS CT ATLANTICO DEL MEDICAMENTO S A CEAMED S A (ES) 2016-08-17 EP disclosed
US-20150175585-A1 FUSED QUINONIC COMPOUNDS CENTRO ATLANTICO DEL MEDICAMENTO S.A (CEAMED S.A.) (ES) 2015-06-25 US disclosed
EP-2877455-A1 FUSED QUINONIC COMPOUNDS Centro Atlantico del Medicamento S.A (Ceamed, S.A) (ES) 2015-06-03 EP disclosed
WO-2014016314-A1 FUSED QUINONIC COMPOUNDS CENTRO ATLANTICO DEL MEDICAMENTO S.A (CEAMED, S.A) (ES) 2014-01-30 WO disclosed
EP-2690094-A1 Fused quinonic compounds Centro Atlantico del Medicamento S.A (Ceamed, S.A) (ES) 2014-01-29 EP 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-20150175585-A1 FUSED QUINONIC COMPOUNDS STAT3, STAT1, JAK2 NQO2 337/4885ALDH1A1 3575/4885GLA 3050/4885

“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.