SCHEMBL6030709

SCHEMBL6030709

FC(F)(F)c1cc(-c2ccco2)nc2c(Cl)cnn12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.69
TDP1 Q9NUW8 1/20 0.69
ALDH1A1 P00352 13/20 0.63
HPGD P15428 11/20 0.63
HSD17B10 Q99714 9/20 0.63
CASP1 P29466 8/20 0.63
CASP7 P55210 8/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
GAA P10253 3/20 0.63
POLB P06746 2/20 0.63
ESR1 P03372 2/20 0.63
ESR2 Q92731 1/20 0.63
MAPT P10636 6/20 0.60
TSHR P16473 3/20 0.60
GLA P06280 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
ALOX15 P16050 4/20 0.57
MAPK1 P28482 3/20 0.57
USP2 O75604 2/20 0.57

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
SCHEMBL6030811 0.85 KDM4E (0.69) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL13401733 0.82 KDM4E (1.00) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL6030690 0.79 KDM4E (0.64) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL31560205 0.76 ALDH1A1 (0.67) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL1718921 0.75 ALDH1A1 (0.61) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL4206860 0.75 HPGD (1.00) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL4216963 0.75 HPGD (1.00) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL6030114 0.75 KDM4E (0.61) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL2543331 0.75 ALDH1A1 (0.74) KDM4ETDP1ALDH1A1HPGDHSD17B10
SCHEMBL4204320 0.74 HPGD (0.84) KDM4ETDP1ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098335-B2 Pyrazolopyrimidine compositions ICAGEN, INC. (US) 2006-08-29 US disclosed
US-20050215569-A1 Pyrazolopyrimidines ICAGEN, INC. (US) 2005-09-29 US disclosed
US-6833371-B2 Contacting cell with a sodium channel-inhibiting amount of a compound comprising a pyrazolopyrimidine moiety for decreasing ion flow through a voltage-dependent sodium channel in a cell ICAGEN, INC. 2004-12-21 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-20050215569-A1 Pyrazolopyrimidines SCN3A, TRPV3, P2RX3 KDM4E 2962/4885TDP1 2299/4885ALDH1A1 2830/4885

“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.