SCHEMBL5622185

SCHEMBL5622185

c1ccc2c(c1)C[C@H]1CC[C@@H](C2)N(Cc2ccnc3ccccc23)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.39
XIAP P98170 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
KCNH2 Q12809 1/20 0.38
FAAH O00519 1/20 0.36
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
HSD11B1 P28845 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ARG1 P05089 1/20 0.34
ARG2 P78540 1/20 0.34
OPRM1 P35372 1/20 0.34

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
SCHEMBL5622887 0.93 MEN1 (0.41) LMNAKDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL5622914 0.81 SIGMAR1 (0.45) DRD2DRD3KCNH2
SCHEMBL5621034 0.80 ACHE (0.41) DRD2DRD3KCNH2NCF1
SCHEMBL5621847 0.79 KDM4E (0.46) LMNAKDM4EALDH1A1SMN1; SMN2DRD2
SCHEMBL5620494 0.77 XIAP (0.39) LMNAXIAPDRD2DRD3KCNH2
SCHEMBL5620617 0.77 TRPV6 (0.41) LMNAALDH1A1DRD2DRD3KCNH2
SCHEMBL5621578 0.76 DRD2 (0.39) LMNAALDH1A1DRD2DRD3KCNH2
SCHEMBL5621238 0.76 DRD2 (0.43) LMNADRD2DRD3KCNH2
SCHEMBL5621555 0.76 DRD2 (0.48) LMNAKDM4EALDH1A1SMN1; SMN2DRD2
SCHEMBL5763867 0.76 DRD2 (0.43) LMNADRD2DRD3KCNH2

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-20070173525-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2007-07-26 US claimed
US-20070173525-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2007-07-26 US disclosed
US-20070173525-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2007-07-26 US disclosed
US-20070173525-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2007-07-26 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-20070173525-A1 Tyrosine kinase inhibitors ABL1, JAK2, ERBB2 LMNA 4638/4885KDM4E 1118/4885ALDH1A1 2225/4885

“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.