SCHEMBL3449555

SCHEMBL3449555

Cc1ncc2n1C(=O)N(C1CCN(C(=O)CNC(=O)Nc3ccc(Cl)cc3)CC1)C2

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.57
F2 P00734 3/20 0.57
EPHX2 P34913 1/20 0.43
PRMT3 O60678 2/20 0.41
NR3C1 P04150 7/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL3448778 0.91 F10 (0.59) F10F2EPHX2NR3C1
SCHEMBL3450991 0.86 F10 (0.54) F10F2EPHX2NR3C1NPC1
SCHEMBL3448554 0.86 F10 (0.54) F10F2EPHX2NR3C1
SCHEMBL3448925 0.84 F10 (0.55) F10F2EPHX2PRMT3NR3C1
SCHEMBL3451332 0.84 F10 (0.54) F10F2
SCHEMBL3450151 0.83 F10 (0.54) F10F2EPHX2NR3C1RAB9A
SCHEMBL3449255 0.83 F10 (0.51) F10F2EPHX2NR3C1
SCHEMBL3450217 0.83 F10 (0.54) F10F2EPHX2NR3C1
SCHEMBL3450095 0.83 F10 (0.54) F10F2EPHX2NR3C1RAB9A
SCHEMBL3450191 0.83 F10 (0.54) F10F2EPHX2NR3C1RAB9A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-20070093501-A1 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-26 US disclosed
US-20070093501-A1 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-26 US disclosed
US-20070093501-A1 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-26 US disclosed
EP-1695961-A1 UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2006-08-30 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-20070093501-A1 Urea derivative, process for producing the same, and use F2, URB2, F12 F10 22/4885F2 1/4885EPHX2 607/4885

“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.