SCHEMBL12425916

SCHEMBL12425916

CC1C[C@@H](Oc2ccc(C(F)(F)F)cn2)CCN1C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 10/20 0.52
LIPG Q9Y5X9 1/20 0.48
HSD11B1 P28845 3/20 0.45
EPHX2 P34913 1/20 0.43
HCRTR1 O43613 5/20 0.43

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
SCHEMBL20145199 0.81 LIPE (0.55) LIPELIPGHSD11B1EPHX2HCRTR1
SCHEMBL20144750 0.79 IL1B (0.55) LIPELIPGHSD11B1HCRTR1
SCHEMBL20145221 0.79 IL1B (0.55) LIPELIPGHSD11B1HCRTR1
SCHEMBL12386003 0.78 LIPE (0.49) LIPELIPGHSD11B1EPHX2HCRTR1
SCHEMBL12425923 0.78 LIPE (0.47) LIPELIPGHSD11B1EPHX2
SCHEMBL1177494 0.78 LIPE (0.49) LIPELIPGHSD11B1EPHX2HCRTR1
SCHEMBL20147461 0.78 LIPE (0.57) LIPELIPGHSD11B1EPHX2
SCHEMBL1177496 0.78 LIPE (0.49) LIPELIPGHSD11B1EPHX2HCRTR1
SCHEMBL20070180 0.78 LIPE (0.57) LIPELIPGHSD11B1EPHX2
SCHEMBL20070188 0.77 LIPE (0.56) LIPELIPGHSD11B1EPHX2

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-7999102-B2 Cross-linked cyclic amine compounds and agents for pest control NIPPON SODA CO., LTD. (JP) 2011-08-16 US disclosed
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-12-24 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-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control CYCS, NPY1R, CYBB LIPE 3893/4885LIPG 4869/4885HSD11B1 2667/4885

“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.