SCHEMBL11765286

SCHEMBL11765286

O=C1C(O)=C([N+](=O)[O-])C(=O)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
POLB P06746 3/20 0.62
CACNA1B Q00975 1/20 0.62
APBA1 Q02410 1/20 0.62
ATM Q13315 1/20 0.62
RXFP1 Q9HBX9 1/20 0.62
APAF1 O14727 2/20 0.58
TDP2 O95551 2/20 0.58
MAPT P10636 4/20 0.50
APEX1 P27695 1/20 0.50
CASP6 P55212 1/20 0.50
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 3/20 0.47
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL10623346 0.85 ALDH1A1 (0.55) MEN1KMT2APOLBCACNA1BAPBA1
SCHEMBL30716831 0.81 ALDH1A1 (0.52) MEN1KMT2APOLBCACNA1BAPBA1
SCHEMBL3134949 0.78 MEN1 (0.47) MEN1KMT2APOLBCACNA1BAPBA1
SCHEMBL9452620 0.76 ALDH1A1 (0.49) MEN1KMT2APOLBCACNA1BAPBA1
SCHEMBL10494249 0.76 LCK (0.46) MEN1KMT2APOLBCACNA1BAPBA1
SCHEMBL29678361 0.75 APAF1 (1.00) MEN1KMT2APOLBAPAF1TDP2
SCHEMBL461648 0.75 APAF1 (1.00) MEN1KMT2APOLBAPAF1TDP2
Anthraquinone SCHEMBL30656132 0.73 MEN1 (0.63) MEN1KMT2APOLBAPAF1TDP2
Anthraquinone SCHEMBL11147007 0.73 MEN1 (0.63) MEN1KMT2APOLBAPAF1TDP2
SCHEMBL15765937 0.72 ALDH1A1 (0.43) MEN1KMT2APOLBCACNA1BAPBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10450281-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-10-22 US disclosed
US-9725425-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-08 US disclosed
US-9725425-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-08 US disclosed
US-9725425-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-08 US disclosed
US-20070026398-A1 Protein tyrosine phosphatase-prl-1 a a marker and therapeutic target for pancreatic cancer ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2007-02-01 US disclosed
US-4017639-A 2-Hydroxy-3-nitro-1,4-naphthoquinones for the prophylaxis of certain allergies BEECHAM GROUP LIMITED (GB) 1977-04-12 US disclosed
US-4014907-A ANTIALLERGENS BEECHAM GROUP LIMITED (EN) 1977-03-29 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 (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-10450281-B1 Compounds and methods for treating cancer USP8, USP2, NEDD8 MEN1 2034/4885KMT2A 230/4885POLB 3098/4885

“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.