SCHEMBL2316355

SCHEMBL2316355

NN=Cc1cc(F)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
AR P10275 1/20 0.41
GRIN2D O15399 2/20 0.41
GRIN3B O60391 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
GRIN3A Q8TCU5 2/20 0.41
CA9 Q16790 3/20 0.40
CA3 P07451 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
KDM1A O60341 2/20 0.39
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 3/20 0.37

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
SCHEMBL2774496 0.82 MAPT (0.55) MAOBARGRIN2DGRIN3BGRIN1
SCHEMBL10710069 0.82 MAPT (0.55) MAOBARGRIN2DGRIN3BGRIN1
SCHEMBL2774494 0.82 MAPT (0.55) MAOBARGRIN2DGRIN3BGRIN1
SCHEMBL2320609 0.79 AMY1A (0.53) MAOBKDM4EKMT2AGAAMAPT
SCHEMBL17526396 0.79 NFE2L2 (0.48) MAOBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18372473 0.79 AMY1A (0.53) MAOBKDM4EKMT2AGAAMAPT
SCHEMBL8821791 0.78 CA2 (0.55) MAOBARCA9CA3CA6
SCHEMBL8821790 0.78 CA2 (0.55) MAOBARCA9CA3CA6
SCHEMBL31681674 0.77 KDM1A (0.49) KDM1AKDM4EKMT2AGAAMAPT
SCHEMBL14906945 0.76 CA12 (0.58) MAOBCA9KDM1AKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES KARTNER NORBERT 2011-08-04 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-20110189306-A1 COMPOUNDS, COMPOSITIONS AND TREATMENTS FOR V-ATPase RELATED DISEASES ATP6V1E1, ATP6V1G1, ATP6V1H MAOB 917/4885AR 4775/4885GRIN2D 3388/4885

“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.