SCHEMBL16612124

SCHEMBL16612124

CC1(C)OB(c2cccc(OCCNC(=O)O)c2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.46
MTNR1B P49286 2/20 0.46
POLB P06746 1/20 0.45
HIF1A Q16665 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 2/20 0.42
PPARD Q03181 1/20 0.42
F10 P00742 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL16612477 0.96 L3MBTL1 (0.46) MTNR1AMTNR1BPOLBHIF1ASMN1; SMN2
SCHEMBL23484589 0.90 MTNR1A (0.59) MTNR1AMTNR1BALDH1A1L3MBTL1
SCHEMBL16014145 0.85 PDK2 (0.49) MTNR1AMTNR1BHIF1A
SCHEMBL16468330 0.85 HIF1A (0.48) MTNR1AMTNR1BHIF1ANPC1
SCHEMBL18124821 0.83 LIPG (0.50) HIF1A
SCHEMBL22816590 0.82 MTNR1A (0.52) MTNR1AMTNR1BPOLBALDH1A1L3MBTL1
SCHEMBL4124783 0.82 CA12 (0.48)
SCHEMBL27075535 0.81 LIPG (0.43) HIF1ASMN1; SMN2ALDH1A1PPARDKDM4E
SCHEMBL1561011 0.81 HIF1A (0.47) MTNR1AMTNR1BHIF1ANPC1L3MBTL1
SCHEMBL1572881 0.81 LMNA (0.54) HIF1AALDH1A1HPGDKDM4E

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 4 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
EP-2857404-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVE AS KINASE INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2015-04-08 EP 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-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS ROS1, JAK1, ERBB2 MTNR1A 1095/4885MTNR1B 1196/4885POLB 3415/4885

“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.