SCHEMBL3449115

SCHEMBL3449115

COc1ccc(NC(=O)NC(C(=O)N2CCC(N3Cc4cnc(C)n4C3=O)CC2)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.45
F2 P00734 2/20 0.45
CCR3 P51677 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 1/20 0.38
BACE1 P56817 1/20 0.38
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
CASR P41180 1/20 0.36
EPHX2 P34913 1/20 0.36
KCNH2 Q12809 1/20 0.36
FPR2 P25090 1/20 0.35
RAB9A P51151 1/20 0.35
GLA P06280 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
SCHEMBL3447656 0.93 F10 (0.47) F10F2EPHX2RAB9A
SCHEMBL13108491 0.92 F10 (0.44) F10F2CCR3EPHX2KCNH2
SCHEMBL3449330 0.92 F10 (0.45) F10F2CCR3MEN1KMT2A
SCHEMBL3451847 0.91 F10 (0.51) F10F2FPR2
SCHEMBL13108483 0.91 F10 (0.44) F10F2CCR3KMT2AALDH1A1
SCHEMBL3450667 0.91 F10 (0.51) F10F2FPR2
SCHEMBL3447682 0.91 F10 (0.44) F10F2FPR2
SCHEMBL3452011 0.91 F10 (0.44) F10F2CCR3KMT2AALDH1A1
SCHEMBL3449674 0.91 F10 (0.51) F10F2FPR2
SCHEMBL3449247 0.89 F10 (0.43) F10F2MEN1KMT2AFPR2

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 1/4885CCR3 3188/4885

“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.