SCHEMBL2945335

SCHEMBL2945335

COCCOc1ccc(-c2cn3nc(OCC4CC4)ccc3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDR P35968 1/20 0.39
HRH3 Q9Y5N1 3/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.38
FFAR1 O14842 1/20 0.37
DRD2 P14416 1/20 0.35
DRD3 P35462 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
SCHEMBL5240562 0.89 PDE10A (0.41) PDE10ANPC1RAB9ARXFP1HRH3
SCHEMBL13236492 0.88 RAB9A (0.46) PDE10ANPC1RAB9ARXFP1HRH3
SCHEMBL2953031 0.84 NPC1 (0.51) PDE10ANPC1RAB9ARXFP1HRH3
SCHEMBL15473552 0.81 PDE10A (0.40) PDE10AHRH3
SCHEMBL2952526 0.78 NPC1 (0.43) NPC1RAB9ARXFP1HRH3KDM4E
SCHEMBL13236502 0.77 KDM1A (0.35)
SCHEMBL2952528 0.74 NPC1 (0.47) PDE10ANPC1RAB9AKDM4EALDH1A1
SCHEMBL15473558 0.74 PDE10A (0.43) PDE10ANPC1RAB9ARXFP1KDR
SCHEMBL2946483 0.74 HRH3 (0.47) NPC1RAB9AHRH3KDM4EALDH1A1
SCHEMBL2947288 0.73 RXFP1 (0.48) NPC1RAB9ARXFP1HRH3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759349-B2 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2010-07-20 US disclosed
US-7759349-B2 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2010-07-20 US disclosed
US-7759349-B2 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2010-07-20 US disclosed
EP-1699799-B1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES SCHERING PLOUGH LTD (CH) 2007-05-16 EP disclosed
EP-1699799-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES Schering-Plough Ltd. (CH) 2006-09-13 EP disclosed
US-20050182059-A1 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2005-08-18 US disclosed
WO-2005066177-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES SCHERING-PLOUGH LTD. (CH) 2005-07-21 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-20050182059-A1 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives PLPBP, PIR, PPIP5K2 PDE10A 3871/4885NPC1 4114/4885RAB9A 1319/4885

“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.