SCHEMBL6821976

SCHEMBL6821976

CC(C)n1nc(-c2c(-c3ccccc3)nn3cc(OCC(=O)N4C[C@@H](C)O[C@@H](C)C4)ccc23)ccc1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 2/20 0.39
CYP2C19 P33261 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.37
ADORA1 P30542 1/20 0.37
HRH3 Q9Y5N1 1/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL6822155 0.88 LMNA (0.46) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6822527 0.87 POLB (0.45) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6821461 0.86 HRH3 (0.41) TDP1KDM4EALDH1A1POLBMEN1
SCHEMBL6818708 0.85 ADORA1 (0.45) MEN1KMT2AADORA1HRH3
SCHEMBL6821994 0.84 HPGD (0.42) KDM4EALDH1A1HPGDSMN1; SMN2TP53
SCHEMBL6822146 0.82 ADORA1 (0.41) KDM4EALDH1A1HPGDSMN1; SMN2ADORA1
SCHEMBL6818718 0.81 HTT (0.42) KDM4EALDH1A1HPGDTP53MEN1
SCHEMBL6822021 0.81 KDM4E (0.42) KDM4EALDH1A1HPGDSMN1; SMN2POLB
SCHEMBL6818525 0.81 ALDH1A1 (0.38) TDP1KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6821408 0.81 KMT2A (0.43) ALDH1A1SMN1; SMN2MEN1KMT2AADORA1

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-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-10 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-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof ADRB1, ADRA1D, ADRB3 TDP1 1502/4885KDM4E 3764/4885ALDH1A1 564/4885

“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.