SCHEMBL6890735

SCHEMBL6890735

CC(C)(C)OC(=O)CNC(=O)N(CCO)CCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.42
SIGMAR1 Q99720 2/20 0.42
LPAR1 Q92633 1/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CTSS P25774 2/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSK P43235 2/20 0.39
PTPRC P08575 2/20 0.39
AKT1 P31749 2/20 0.38
NPY5R Q15761 1/20 0.38
MAPT P10636 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
SCHEMBL6889389 0.89 SIGMAR1 (0.43) USP2SIGMAR1POLBNPC1RAB9A
SCHEMBL6893352 0.85 SIGMAR1 (0.39) SIGMAR1LPAR1POLBNPC1RAB9A
SCHEMBL1845666 0.81 MEN1 (0.46) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL6899498 0.80 ITGA4 (0.43) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL27559935 0.80 POLB (0.44) USP2LPAR1POLBTDP1CTSS
SCHEMBL27560049 0.80 POLB (0.44) USP2LPAR1POLBTDP1CTSS
SCHEMBL27538205 0.78 MMP1 (0.53) POLBTDP1CTSSCTSLCTSB
SCHEMBL27538204 0.78 MMP1 (0.53) POLBTDP1CTSSCTSLCTSB
SCHEMBL27538295 0.78 LPAR1 (0.44) USP2LPAR1POLBTDP1CTSS
SCHEMBL27669824 0.77 TDP1 (0.50) NPC1RAB9AMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730784-B2 AS THERAPEUTIC AGENTS FOR AUTOIMMUNE DISEASES SUCH AS RHEUMATOID ARTHRITIS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-05-04 US disclosed
US-20020198376-A1 Novel urea derivatives SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-26 US disclosed
US-6492370-B1 Urea derivatives and pharmaceutical compositions thereof SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-10 US disclosed
EP-1072591-A1 NOVEL UREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-01-31 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-20020198376-A1 Novel urea derivatives TNF, CTH, CFH USP2 163/4885SIGMAR1 26/4885LPAR1 4229/4885

“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.