SCHEMBL2881292

SCHEMBL2881292

O=c1[nH]c(-c2nn(Cc3cccc(F)c3)c3ncccc23)no1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
GUCY1A1 Q02108 2/20 0.43
GUCY1B1 Q02153 2/20 0.43
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
ATM Q13315 1/20 0.39
AGTR1 P30556 1/20 0.38
PDE5A O76074 4/20 0.37
KMT2A Q03164 2/20 0.37
MET P08581 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL2883555 0.85 PDE5A (0.42) PDE5A
SCHEMBL2883492 0.85 PDE5A (0.42) GUCY1A1GUCY1B1PDE5A
SCHEMBL2883500 0.85 PDE5A (0.42) PDE5A
SCHEMBL2883785 0.82 PDE5A (0.47) GUCY1A1GUCY1B1PDE5A
SCHEMBL2880871 0.82 PDE5A (0.52) PDE5A
SCHEMBL2883894 0.80 PDE5A (0.45) GUCY1A1GUCY1B1PDE5A
SCHEMBL2885436 0.80 PDE5A (0.42) MAPTGUCY1A1GUCY1B1PDE5A
SCHEMBL2881270 0.77 AGTR1 (0.36) MAPTL3MBTL1AGTR1PDE5A
SCHEMBL21787287 0.77 L3MBTL1 (0.45) MAPTGUCY1A1GUCY1B1L3MBTL1POLB
SCHEMBL20140459 0.75 MAPT (0.43) MAPTGUCY1A1GUCY1B1L3MBTL1POLB

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-20100004235-A1 Heterocyclic Substituted, Anellated Pyrazole Derivative and its uses BAYER HEALTHCARE AG (DE) 2010-01-07 US disclosed
EP-2013205-A1 HETEROCYCLIC SUBSTITUTED, ANELLATED PYRAZOLE DERIVATIVE AND ITS USES Bayer HealthCare AG (DE) 2009-01-14 EP disclosed
WO-2007124854-A1 HETEROCYCLIC SUBSTITUTED, ANELLATED PYRAZOLE DERIVATIVE AND ITS USES BAYER HEALTHCARE AG (DE) 2007-11-08 WO disclosed
WO-2007124854-A1 HETEROCYCLIC SUBSTITUTED, ANELLATED PYRAZOLE DERIVATIVE AND ITS USES BAYER HEALTHCARE AG (DE) 2007-11-08 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-20100004235-A1 Heterocyclic Substituted, Anellated Pyrazole Derivative and its uses AADAC, CYP11B2, PC MAPT 4591/4885GUCY1A1 3414/4885GUCY1B1 2565/4885

“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.