SCHEMBL16468014

SCHEMBL16468014

O=C(O)NC1(COc2ccc(Br)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DRD1 P21728 1/20 0.42
PTGER2 P43116 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TSHR P16473 1/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
POLB P06746 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL29672453 0.87 RXRA (0.42) KDM4EALDH1A1SMN1; SMN2DRD1PTGER2
SCHEMBL16491275 0.80 SMN1; SMN2 (0.42) KDM4EALDH1A1SMN1; SMN2
SCHEMBL4419864 0.77 LMNA (0.46) KDM4EALDH1A1PTGER2MEN1KMT2A
SCHEMBL1977522 0.76 DRD1 (0.58) KDM4EALDH1A1SMN1; SMN2DRD1PTGER2
SCHEMBL16040906 0.76 ADRB2 (0.44) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL16468281 0.76 HIF1A (0.46)
SCHEMBL6138302 0.74 NOTUM (0.43)
SCHEMBL15537468 0.73 DRD1 (0.55) DRD1PTGER2HRH4RXRARXRB
SCHEMBL25256391 0.73 TSHR (0.33) KDM4EALDH1A1KMT2ATSHR
SCHEMBL9936512 0.72 DRD1 (0.45) KDM4EALDH1A1SMN1; SMN2DRD1PTGER2

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
US-9751887-B2 Imidazo[1,2-b]pyridazine derivatives as kinase inhibitors DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-09-05 US disclosed
EP-2857404-B1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO CO LTD (JP) 2017-08-23 EP disclosed
US-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-02-18 US disclosed
US-9187489-B2 Imidazo[1,2-b]pyridazine derivatives as kinase inhibitors DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-11-17 US disclosed
EP-2857404-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVE AS KINASE INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2015-04-08 EP disclosed
US-20150051190-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-19 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 (2 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-20150051190-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS ROS1, JAK1, ERBB2 KDM4E 2596/4885ALDH1A1 860/4885SMN1; SMN2 2475/4885
US-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS ROS1, JAK1, ERBB2 KDM4E 2596/4885ALDH1A1 860/4885SMN1; SMN2 2475/4885

“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.