SCHEMBL7004560

SCHEMBL7004560

O=c1c2c[nH]nc2ncn1Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
KDM4E B2RXH2 5/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 2/20 0.46
MMP13 P45452 1/20 0.45
KCNH2 Q12809 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
GRK2 P25098 2/20 0.42
THRB P10828 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42

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
SCHEMBL7003110 0.88 TP53 (0.53) MEN1KMT2ALMNAGAAPKM
SCHEMBL7002674 0.86 GRK2 (0.52) SMN1; SMN2LMNAKDM4EL3MBTL1HPGD
SCHEMBL7003741 0.85 KDM4E (0.49) KDM4EL3MBTL1ALDH1A1MMP13HPGD
SCHEMBL7002186 0.80 TSHR (0.45) HTTLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL7004569 0.78 KDM4E (0.55) SMN1; SMN2HTTLMNAKDM4EL3MBTL1
SCHEMBL7000183 0.77 SMN1; SMN2 (0.51) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL7004474 0.76 ALDH1A1 (0.51) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL12761304 0.75 RAB9A (0.40) SMN1; SMN2ALDH1A1HDAC6
SCHEMBL7002562 0.75 KDM4E (0.53) SMN1; SMN2MEN1KMT2ALMNAKDM4E
SCHEMBL7003807 0.74 PDE5A (0.51) SMN1; SMN2HTTMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186997-A1 2,5-Dihydro-pyrazolo[3,4-d]pyrimidin-4-ones with an anticonsulsive action and methods for producing the same ELBION AG (DE) 2003-10-02 US claimed
US-20030186997-A1 2,5-Dihydro-pyrazolo[3,4-d]pyrimidin-4-ones with an anticonsulsive action and methods for producing the same ELBION AG (DE) 2003-10-02 US disclosed
EP-1311510-A1 2,5-DIHYDRO-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ARZNEIMITTELWERK DRESDEN GMBH (DE) 2003-05-21 EP disclosed
WO-2002018387-A1 2,5-DIHYDRO-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ELBION AG (DE) 2002-03-07 WO 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-20030186997-A1 2,5-Dihydro-pyrazolo[3,4-d]pyrimidin-4-ones with an anticonsulsive action and methods for producing the same DDO, GRIN3A, GRIK4 SMN1; SMN2 861/4885HTT 668/4885MEN1 2351/4885

“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.