SCHEMBL1640484

SCHEMBL1640484

CC(C)n1nc(-c2ccc3c(c2)CCN(C2=CC=C2)CC3)ccc1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 3/20 0.44
BMPR1A P36894 3/20 0.44
ACVRL1 P37023 3/20 0.44
ACVR1 Q04771 3/20 0.44
TGFBR1 P36897 2/20 0.44
HRH3 Q9Y5N1 5/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34
POLB P06746 2/20 0.34
FLT3 P36888 2/20 0.33
SYK P43405 2/20 0.33
HSD11B1 P28845 1/20 0.33
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
AURKB Q96GD4 1/20 0.31
NOTUM Q6P988 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL1639547 0.85 HRH3 (0.44) HRH3CA1CA2
SCHEMBL1640798 0.85 HRH3 (0.45) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL1640533 0.84 CA1 (0.36) HRH3CA1CA2MAPTTP53
SCHEMBL1640003 0.83 BMPR1B (0.48) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL1640859 0.79 PDE4A (0.40) CA1CA2POLBTP53KDM4E
SCHEMBL1640521 0.79 BMPR1B (0.48) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL1640497 0.78 HRH3 (0.40) HRH3CA1CA2POLBKDM4E
SCHEMBL1640483 0.78 HRH3 (0.59) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL1640871 0.78 HRH3 (0.40) HRH3CA1CA2HSD11B1TP53
SCHEMBL1638976 0.77 CA1 (0.58) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328586-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS Cephalon, Inc. (US) 2011-06-08 EP claimed
US-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON, INC. (US) 2011-04-28 US claimed
WO-2009142732-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2009-11-26 WO claimed
EP-2328586-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS Cephalon, Inc. (US) 2011-06-08 EP disclosed
US-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON, INC. (US) 2011-04-28 US disclosed
WO-2009142732-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2009-11-26 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-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands HRH3, HRH4, HRH2 BMPR1B 1242/4885BMPR1A 1420/4885ACVRL1 2490/4885

“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.