SCHEMBL2871017

SCHEMBL2871017

CCc1cn2ccnc(Cl)c2n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KCNH2 Q12809 2/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
RECQL P46063 1/20 0.33
ROCK1 Q13464 1/20 0.32
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
PKM P14618 1/20 0.31
AURKA O14965 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
SCHEMBL14450080 0.88 L3MBTL1 (0.39) PDE10AL3MBTL1KCNH2NPC1RAB9A
SCHEMBL14164716 0.83 TLR7 (0.37) PDE10AKCNH2ALDH1A1POLB
SCHEMBL6998356 0.82 ALDH1A1 (0.40) KCNH2NPC1RAB9ARECQLKDM4E
SCHEMBL22291045 0.81 L3MBTL1 (0.39) PDE10AL3MBTL1NPC1RAB9AKDM4E
SCHEMBL19347319 0.79 NUDT1 (0.50) PDE10AL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL7083481 0.77 CRHR1 (0.41)
SCHEMBL20595996 0.77 KDM4E (0.43) L3MBTL1RAB9ARECQLKDM4EALDH1A1
SCHEMBL2179459 0.77 L3MBTL1 (0.41) L3MBTL1NPC1RAB9AROCK1KDM4E
Bromide SCHEMBL17873904 0.75 L3MBTL1 (0.40) L3MBTL1NPC1RAB9AROCK1KDM4E
SCHEMBL24963642 0.73 TNKS (0.36) PDE10AL3MBTL1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772249-B2 Imidazo[1,2-b]pyridazine compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090181985-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-07-16 US disclosed
US-20060211696-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-09-21 US disclosed
US-7078405-B2 Imidazo[1,2-b]pyridazine compound EISAI CO., LTD. (JP) 2006-07-18 US disclosed
US-20040082781-A1 Bicyclic nitrogenous fused-ring compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-04-29 US disclosed
US-20030220342-A1 Imidazo[1, 2-a] pyrazines for the treatment of irritable bowel syndrome BAKTHAVATCHALAM RAJAGOPAL (US) 2003-11-27 US disclosed
EP-1364952-A1 BICYCLIC NITROGENOUS FUSED-RING COMPOUND Eisai Co., Ltd. (JP) 2003-11-26 EP disclosed
US-6589952-B2 Imidazo(1,2-a)pyrazines containing an aryl or heteroaryl group are useful as (corticotropin releasiang factor) CRF receptor antagonists in the treatment of various neurological and psychological disorders BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-07-08 US disclosed
EP-1301511-A2 IMIDAZO 1,2-a]PYRAZINES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Bristol-Myers Squibb Pharma Company (US) 2003-04-16 EP disclosed
US-20020049208-A1 Imidazo[1,2-a]pyrazines for the treatment of neurological disorders BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-25 US disclosed
WO-2002006286-A2 IMIDAZO[1,2-a]PYRAZINES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-24 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 (5 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-20060211696-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND CRHR1, CRHR2, CRH PDE10A 1312/4885L3MBTL1 3734/4885KCNH2 1084/4885
US-20030220342-A1 Imidazo[1, 2-a] pyrazines for the treatment of irritable bowel syndrome SCN5A, HRH2, CHRNA5 PDE10A 2065/4885L3MBTL1 4682/4885KCNH2 417/4885
US-20090181985-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND CRHR1, CRHR2, CRH PDE10A 1312/4885L3MBTL1 3734/4885KCNH2 1084/4885
US-20020049208-A1 Imidazo[1,2-a]pyrazines for the treatment of neurological disorders CRHR1, CRHR2, CRH PDE10A 1214/4885L3MBTL1 4396/4885KCNH2 2254/4885
US-20040082781-A1 Bicyclic nitrogenous fused-ring compound CRHR1, CRH, CRHR2 PDE10A 1783/4885L3MBTL1 3135/4885KCNH2 1265/4885

“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.