SCHEMBL2374866

SCHEMBL2374866

Cc1nc(C2CC2)ncc1C(=O)N(C)c1ccnnc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLNR O43193 1/20 0.34
HPGD P15428 2/20 0.33
PIK3C3 Q8NEB9 1/20 0.32
NFKB1 P19838 2/20 0.32
FOS P01100 1/20 0.32
JUN P05412 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
HPGDS O60760 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ATF1 P18846 1/20 0.31
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31
HTR2C P28335 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 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
SCHEMBL2374871 0.73 HPGD (0.37) HPGDPIK3C3NFKB1FOSJUN
SCHEMBL932772 0.72 GPBAR1 (0.37)
SCHEMBL2374960 0.72 HPGD (0.51) HPGDPIK3C3NFKB1FOSJUN
SCHEMBL12978332 0.71 ALDH1A1 (0.34) SMN1; SMN2HTR2CALDH1A1
SCHEMBL3825471 0.70 NNMT (0.39) HPGDNFKB1FOSJUNNFKB2
SCHEMBL16660723 0.68 KMT2A (0.38) SMN1; SMN2MEN1LMNAKMT2A
SCHEMBL20542388 0.68 ROCK2 (0.38) ROCK2ROCK1HTR2CALDH1A1MEN1
SCHEMBL16660728 0.68 KMT2A (0.38) SMN1; SMN2MEN1LMNAKMT2A
SCHEMBL16660727 0.66 KMT2A (0.36) MEN1TSHRKMT2AHSD17B10
SCHEMBL15662045 0.66 KMT2A (0.36) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550264-B1 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2016-06-08 EP disclosed
US-9040537-B2 Pyridazine compounds for controlling invertebrate pests BASF SE (DE) 2015-05-26 US disclosed
EP-2550264-A1 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2013-01-30 EP disclosed
US-20130012380-A1 Pyridazine Compounds For Controlling Invertebrate Pests BASF SE (DE) 2013-01-10 US disclosed
WO-2011117286-A1 PYRIDAZINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2011-09-29 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-20130012380-A1 Pyridazine Compounds For Controlling Invertebrate Pests GRIN2C, GRIN2A, NR2C2 MLNR 2992/4885HPGD 1662/4885PIK3C3 4069/4885

“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.