SCHEMBL6030690

SCHEMBL6030690

FC(F)(F)c1cc(-c2ccccc2)nc2c(Cl)cnn12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.64
HPGD P15428 8/20 0.64
ALDH1A1 P00352 8/20 0.64
HSD17B10 Q99714 7/20 0.64
MAPT P10636 4/20 0.64
MAPK1 P28482 3/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
TSHR P16473 4/20 0.57
CASP1 P29466 2/20 0.57
CASP7 P55210 2/20 0.57
NPSR1 Q6W5P4 3/20 0.56
TP53 P04637 2/20 0.56
CYP3A4 P08684 2/20 0.56
GAA P10253 2/20 0.56
CYP1A2 P05177 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
POLB P06746 1/20 0.56
USP2 O75604 1/20 0.51
PKM P14618 1/20 0.51

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
SCHEMBL6031904 0.86 KDM4E (0.68) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL22680482 0.83 MAPT (0.71) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL6029324 0.83 CDK2 (0.64) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL3283135 0.81 KDM4E (0.84) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL29152855 0.81 ALDH1A1 (0.52) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL1009507 0.80 CSNK2A1 (0.67) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL6030709 0.79 KDM4E (0.69) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL6030114 0.79 KDM4E (0.61) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL15760566 0.78 KDM4E (0.78) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL1925379 0.78 MAPT (0.67) KDM4EHPGDALDH1A1HSD17B10MAPT

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 2962/4885HPGD 854/4885ALDH1A1 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.