SCHEMBL5872004

SCHEMBL5872004

COc1ccc(OCc2cc(C)c3c(=O)cc(Nc4ccccc4)n(-c4ccccc4)c3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.43
CYP3A4 P08684 4/20 0.43
TSHR P16473 4/20 0.43
USP2 O75604 3/20 0.43
CYP2C9 P11712 3/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
ALDH1A1 P00352 5/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
PDE11A Q9HCR9 1/20 0.41
RXFP1 Q9HBX9 2/20 0.39
CYP2C19 P33261 2/20 0.39
CLK4 Q9HAZ1 1/20 0.39
PRKDC P78527 2/20 0.39
MAPT P10636 4/20 0.38
MAPK1 P28482 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 2/20 0.38
PIK3CA P42336 1/20 0.38

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
SCHEMBL8287109 0.85 MAPT (0.51) CYP1A2CYP3A4TSHRUSP2CYP2C9
SCHEMBL8358815 0.82 MAPT (0.45) CYP1A2CYP3A4TSHRUSP2CYP2C9
SCHEMBL5871689 0.82 PDE11A (0.46) TSHRALDH1A1PDE11AMAPTMAPK1
SCHEMBL5872118 0.81 PDE11A (0.46) ALDH1A1MEN1KMT2APDE11AMAPT
SCHEMBL8287389 0.81 PDE11A (0.47) CYP1A2CYP3A4TSHRUSP2CYP2C9
SCHEMBL8287207 0.79 CYP1A2 (0.41) CYP1A2CYP3A4TSHRUSP2CYP2C9
SCHEMBL8285246 0.79 PDE11A (0.39) CYP1A2CYP3A4TSHRUSP2CYP2C9
SCHEMBL8287167 0.79 PDE11A (0.44) ALDH1A1PDE11AMAPTMAPK1POLB
SCHEMBL8285163 0.78 POLB (0.50) TSHRALDH1A1MEN1KMT2APDE11A
SCHEMBL5871799 0.78 PDE11A (0.50) CYP1A2TSHRALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109196-B2 1,8 Naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-09-19 US disclosed
US-20060189609-A1 1, 8-Naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-24 US disclosed
US-6964971-B2 1,6-naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION (US) 2005-11-15 US disclosed
WO-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
WO-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
US-6900205-B2 1,8-Naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION (US) 2005-05-31 US disclosed
US-20040209866-A1 1,8 Naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION 2004-10-21 US disclosed
US-20040157875-A1 1, 6-Naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION 2004-08-12 US disclosed
US-6677352-B1 1,6-naphthyridine derivatives and their use to treat diabetes and related disorders BAYER PHARMACEUTICALS CORPORATION 2004-01-13 US disclosed
WO-2003027112-A1 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 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 (3 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-20040157875-A1 1, 6-Naphthyridine derivatives and their use to treat diabetes and related disorders GLP1R, NQO1, UQCRC1 CYP1A2 288/4885CYP3A4 501/4885TSHR 2122/4885
US-20040209866-A1 1,8 Naphthyridine derivatives and their use to treat diabetes and related disorders SLC5A1, NQO1, GLP1R CYP1A2 193/4885CYP3A4 532/4885TSHR 2197/4885
US-20060189609-A1 1, 8-Naphthyridine derivatives and their use to treat diabetes and related disorders GLP1R, UQCRC1, SLC5A1 CYP1A2 312/4885CYP3A4 651/4885TSHR 1642/4885

“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.