SCHEMBL17540258

SCHEMBL17540258

COC(=O)C1(C)CC(=O)N([C@@H](C)c2ccc(OC)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.42
KMT2A Q03164 4/20 0.41
ATM Q13315 1/20 0.41
OPRK1 P41145 1/20 0.41
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL28094478 0.90 KMT2A (0.46) HSD11B1KMT2AATMMMP1MMP2
SCHEMBL16468250 0.90 KMT2A (0.46) HSD11B1KMT2AATMMMP1MMP2
SCHEMBL16491324 0.88 HSD11B1 (0.40) HSD11B1KMT2AATMOPRK1MMP1
SCHEMBL19308424 0.88 HSD11B1 (0.40) HSD11B1KMT2AATMOPRK1MMP1
SCHEMBL3974883 0.87 KMT2A (0.45) HSD11B1KMT2ALMNASMN1; SMN2MEN1
SCHEMBL19263584 0.85 HSD11B1 (0.42) HSD11B1KMT2AATMOPRK1MMP1
SCHEMBL24629570 0.84 CA1 (0.44) KMT2AATMLMNASMN1; SMN2MEN1
SCHEMBL16467977 0.81 HSD11B1 (0.41) HSD11B1KMT2AATMMMP1MMP2
SCHEMBL24629571 0.80 HSD11B1 (0.44) HSD11B1KMT2AATMMMP1MMP2
SCHEMBL16468280 0.79 HSD11B1 (0.45) HSD11B1KMT2AATMMMP1MMP2

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-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-02-18 US disclosed
US-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-02-18 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-20160046639-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS ROS1, JAK1, ERBB2 HSD11B1 1177/4885KMT2A 2025/4885ATM 2503/4885

“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.