SCHEMBL3448667

SCHEMBL3448667

Cc1nc(C)n2c1CN(CCC1CCN(C(=O)[C@H](NC(=O)Nc3ccc(Cl)cc3)C(C)(C)C)CC1)C2=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.41
F10 P00742 3/20 0.40
ALOX5 P09917 1/20 0.37
IDO1 P14902 1/20 0.36
TP53 P04637 2/20 0.36
EPHX2 P34913 2/20 0.36
MAPT P10636 1/20 0.36
F2 P00734 1/20 0.35
NR3C1 P04150 2/20 0.35
FPR2 P25090 2/20 0.34
UTS2R Q9UKP6 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
SCHEMBL3449282 0.90 CNR1 (0.38) CCR1F10TP53EPHX2MAPT
SCHEMBL3450686 0.88 F10 (0.49) CCR1F10EPHX2F2NR3C1
SCHEMBL3448490 0.87 F10 (0.46) CCR1F10ALOX5IDO1EPHX2
SCHEMBL3449738 0.86 F10 (0.35) CCR1F10F2
SCHEMBL3450470 0.83 CCR1 (0.37) CCR1F10FPR2UTS2R
SCHEMBL3448422 0.80 F10 (0.46) CCR1F10ALOX5TP53EPHX2
SCHEMBL13123188 0.79 F10 (0.42) CCR1F10EPHX2F2FPR2
SCHEMBL14541581 0.79 F10 (0.42) CCR1F10EPHX2MAPTF2
SCHEMBL3450071 0.76 F10 (0.41) CCR1F10TP53MAPTF2
SCHEMBL3448493 0.76 CCR1 (0.41) CCR1ALOX5IDO1TP53EPHX2

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 CCR1 2570/4885F10 22/4885ALOX5 2510/4885

“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.