SCHEMBL3420569

SCHEMBL3420569

Nc1cccc2[nH]c3ccccc3c(=O)c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.64
TDP1 Q9NUW8 2/20 0.64
ALDH1A1 P00352 5/20 0.61
KDM4E B2RXH2 4/20 0.61
GAA P10253 3/20 0.61
GLA P06280 2/20 0.61
HTT P42858 2/20 0.61
LMNA P02545 2/20 0.61
HPGD P15428 1/20 0.61
ATM Q13315 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
ABCG2 Q9UNQ0 3/20 0.58
IMPDH2 P12268 1/20 0.47
IMPDH1 P20839 1/20 0.47
GPR3 P46089 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 1/20 0.46
CASP6 P55212 1/20 0.46

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
SCHEMBL29519421 1.00 POLB (0.64) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL9614337 0.86 POLB (0.60) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL3433644 0.84 IMPDH2 (0.59) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL30678031 0.84 IMPDH2 (0.59) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL10345038 0.82 ALDH1A1 (0.74) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL4219929 0.78 ALDH1A1 (0.61) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL9709372 0.78 ALDH1A1 (0.61) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL1613016 0.78 PARP1 (0.57) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL11981333 0.78 POLB (1.00) POLBTDP1ALDH1A1KDM4EGAA
SCHEMBL31714622 0.78 ALDH1A1 (0.61) POLBTDP1ALDH1A1KDM4EGAA

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
CN-101218307-B Pigment dispersions with poymeric dispersants having pending chromophore groups AGFA GEVAERT 2012-03-28 CN disclosed
US-7846939-B2 Salts and mixture of 9-oxoacridine-10-acetic acid with 1-alkylamino-1-desoxy-polyols, pharmaceutical compositions containing said agents and treatment methods EPHAG AS (EE) 2010-12-07 US disclosed
US-20100144780-A1 Salts and Mixture of 9-Oxoacridine-10-Acetic Acid with 1-Alkylamino-1-Desoxy-Polyols, Pharmaceutical Compositions Containing Said Agents and Treatment Methods PJSC PHARMSYNTHEZ (RU) 2010-06-10 US disclosed
US-5296602-A Condensing substituted ortho-halo- or ortho-aminobenzoic acid with meta-halo- or meta-aminoanisole, cyclizing, N-alkylating, de-O-methylating SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1994-03-22 US disclosed
WO-1992016509-A1 MULTISUBSTITUTED 1-HYDROXY-9-ACRIDONES WITH ANTICANCER ACTIVITY SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-10-01 WO 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-20100144780-A1 Salts and Mixture of 9-Oxoacridine-10-Acetic Acid with 1-Alkylamino-1-Desoxy-Polyols, Pharmaceutical Compositions Containing Said Agents and Treatment Methods ADSL, ACMSD, ASS1 POLB 776/4885TDP1 529/4885ALDH1A1 12/4885

“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.