SCHEMBL2464356

SCHEMBL2464356

O=C(Nc1ccccc1-c1cc(F)ccc1F)c1ccc2c(O)nnc(Cl)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
KCNMA1 Q12791 1/20 0.40
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
STK33 Q9BYT3 1/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
HDAC1 Q13547 3/20 0.39
KCNQ3 O43525 3/20 0.38
KCNQ2 O43526 3/20 0.38
KCNE1 P15382 3/20 0.38
KCNQ1 P51787 3/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL2459136 0.87 KCNMA1 (0.45) KCNMA1RAB9ANPC1HDAC1KCNQ3
SCHEMBL2463069 0.82 KCNMA1 (0.45) KCNMA1RAB9ANPC1HDAC1KCNQ3
SCHEMBL2462118 0.78 ALDH1A1 (0.50) KMT2AMEN1KCNMA1SMN1; SMN2RAB9A
SCHEMBL2465560 0.77 TMPRSS4 (0.54) KMT2AMEN1RAB9ANPC1HDAC1
SCHEMBL2459540 0.76 JAK2 (0.49) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL2457294 0.74 ALDH1A1 (0.50) KMT2AMEN1KCNMA1SMN1; SMN2RAB9A
SCHEMBL4927155 0.73 TDP1 (0.65) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL2459103 0.72 TMPRSS4 (0.54) KMT2AMEN1RAB9ANPC1HDAC1
SCHEMBL2461216 0.71 JAK2 (0.49) KMT2AMEN1RAB9ANPC1HDAC1
SCHEMBL2464277 0.69 KCNQ3 (0.55) KMT2AMEN1RAB9ANPC1KCNQ3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044041-B2 e.g. 4-Chloro-1-hydroxy-phthalazine-6-carboxylic acid [4-chloro-3'-(2-dimethylamino-ethoxy)-biphenyl-3-yl]-amide; multifunctioning protein kinase inhibitors; anticarcinogenic, antiinflammatory, antidiabetic agent, neurodegenerative diseases FOREST LABORATORIES HOLDINGS LIMITED (BM) 2011-10-25 US disclosed
US-20110237571-A1 PHTHALAZINE DERIVATIVES ARALDI GIAN-LUCA 2011-09-29 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-20110237571-A1 PHTHALAZINE DERIVATIVES CDK5, HIPK2, PACSIN2 KMT2A 502/4885MEN1 2282/4885KCNMA1 2884/4885

“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.