SCHEMBL19010243

SCHEMBL19010243

CC(=O)c1nnc(Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1NCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.64
GAA P10253 8/20 0.64
ALOX15 P16050 7/20 0.64
ALOX12 P18054 7/20 0.64
GFER P55789 5/20 0.64
MAPK1 P28482 3/20 0.64
SYK P43405 1/20 0.56
ENPP2 Q13822 5/20 0.55
KDM4E B2RXH2 7/20 0.52
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TSHR P16473 2/20 0.52
HTT P42858 2/20 0.52
LMNA P02545 2/20 0.52
HSP90AA1 P07900 1/20 0.52
HSP90AB1 P08238 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL17009127 0.93 MAPT (0.61) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010322 0.91 MAPT (0.59) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010288 0.91 GFER (0.68) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010276 0.90 GFER (0.54) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010292 0.90 GFER (0.54) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010260 0.89 MAPT (0.54) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010305 0.89 GFER (0.52) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010258 0.88 GFER (0.50) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010319 0.88 ENPP2 (0.59) MAPTGAAALOX15ALOX12GFER
SCHEMBL19010324 0.87 MAPT (0.47) MAPTGAAALOX15ALOX12GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9834548-B2 Pyridazine compounds as JAK inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS ALEXION PHARMACEUTICALS, INC. 2017-06-22 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-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS JAK1, JAK2, JAK3 MAPT 53/4885GAA 2694/4885ALOX15 1252/4885

“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.