SCHEMBL1785622

SCHEMBL1785622

O=c1[nH]nc(-c2ccccc2)c2cc(F)ccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.67
ATM Q13315 1/20 0.67
MAP2K4 P45985 5/20 0.64
PRMT5 O14744 1/20 0.48
MAPK1 P28482 1/20 0.48
MAPK6 Q16659 1/20 0.48
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ROCK1 Q13464 4/20 0.47
ROCK2 O75116 4/20 0.47
NAMPT P43490 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 2/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL31014287 0.83 NPSR1 (0.71) NPSR1ATMPRMT5MAPK1KDM4E
SCHEMBL4834657 0.83 ATM (0.51) NPSR1ATMMAP2K4PRMT5MAPK1
SCHEMBL7884963 0.81 ATM (0.73) NPSR1ATMMAPK1KDM4EALDH1A1
SCHEMBL29870198 0.81 NPSR1 (1.00) NPSR1ATMMAPK1KDM4EALDH1A1
SCHEMBL581143 0.81 NPSR1 (1.00) NPSR1ATMMAPK1KDM4EALDH1A1
SCHEMBL31014281 0.81 NPSR1 (0.67) NPSR1ATMMAP2K4PRMT5MAPK1
SCHEMBL31014284 0.81 NPSR1 (0.67) NPSR1ATMMAP2K4PRMT5MAPK1
SCHEMBL31014277 0.81 NPSR1 (0.67) NPSR1ATMMAP2K4PRMT5KDM4E
SCHEMBL31014304 0.80 ATM (0.61) NPSR1ATMMAP2K4PRMT5MAPK1
SCHEMBL31014283 0.78 NPSR1 (0.68) NPSR1ATMPRMT5KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118496166-A Preparation method of phthalazinone compound 五邑大学 2024-08-16 CN claimed
CN-118496166-A Preparation method of phthalazinone compound 五邑大学 2024-08-16 CN disclosed
US-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 US disclosed
EP-2504317-A1 POTASSIUM CHANNEL MODULATORS Abbott Laboratories (US) 2012-10-03 EP disclosed
WO-2011066168-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-06-03 WO disclosed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 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-20110124642-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNQ3 NPSR1 505/4885ATM 3548/4885MAP2K4 4448/4885

“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.