SCHEMBL3449332

SCHEMBL3449332

Cc1ccc(NC(=O)NC(C(=O)N2CCC(N3CN4CN(C)C=C4C3=O)CC2)c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.38
FAAH O00519 1/20 0.38
HTR1E P28566 1/20 0.37
S1PR3 Q99500 1/20 0.37
F10 P00742 5/20 0.37
EPHX2 P34913 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
CCR1 P32246 1/20 0.35
FPR2 P25090 2/20 0.35
ALDH1A1 P00352 1/20 0.35
KCNH2 Q12809 1/20 0.35
CCR5 P51681 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
SCHEMBL3447659 0.95 CCR1 (0.39) F10EPHX2CCR1FPR2ALDH1A1
SCHEMBL3447685 0.93 FPR2 (0.45) F10EPHX2MEN1KMT2AFPR2
SCHEMBL3450668 0.93 CCR1 (0.44) F10EPHX2LMNACCR1FPR2
SCHEMBL3451848 0.93 CCR1 (0.44) F10EPHX2LMNACCR1FPR2
SCHEMBL3449677 0.93 CCR1 (0.44) F10EPHX2LMNACCR1FPR2
SCHEMBL3452013 0.93 F10 (0.38) CCR3F10EPHX2LMNACCR1
SCHEMBL3451846 0.91 EPHX2 (0.44) CCR3EPHX2
SCHEMBL3449248 0.91 FPR2 (0.43) F10MEN1KMT2ACCR1FPR2
SCHEMBL3449116 0.91 MEN1 (0.40) CCR3EPHX2MEN1KMT2ALMNA
SCHEMBL3452485 0.90 FAAH (0.35) FAAHF10EPHX2MEN1KMT2A

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 3 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-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 CCR3 3188/4885FAAH 2986/4885HTR1E 2858/4885

“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.