SCHEMBL4373373

SCHEMBL4373373

COc1cccc(COc2ccc(-c3ccc(C(=O)NC(=O)[C@H](CCC(=O)O)NCC45CC6CC(CC(C6)C4)C5)cc3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.43
CNR2 P34972 2/20 0.43
FFAR1 O14842 8/20 0.41
EPHX2 P34913 3/20 0.40
P2RX7 Q99572 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
DHFR P00374 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL2247494 0.88 CCKBR (0.49) FAAHCNR2FFAR1EPHX2P2RX7
SCHEMBL2244033 0.81 CCKBR (0.47) FAAHCNR2EPHX2P2RX7KMT2A
SCHEMBL2245261 0.76 MMP12 (0.56) FFAR1POLBGAAKMT2AALDH1A1
SCHEMBL3583723 0.75 KLKB1 (0.54) DHFR
SCHEMBL2250529 0.73 ADAMTS5 (0.64) FFAR1POLBGAAKMT2ADHFR
SCHEMBL2250713 0.73 MMP12 (0.54) FFAR1ALDH1A1DHFR
SCHEMBL2247496 0.73 HSD17B2 (0.40) FAAHCNR2FFAR1KMT2AMRGPRX4
SCHEMBL2245262 0.73 MRGPRX4 (0.53) POLBGAAKMT2AALDH1A1MRGPRX4
SCHEMBL3595965 0.72 KLKB1 (0.53) FFAR1DHFR
SCHEMBL6030433 0.70 GPR132 (0.65) POLBGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553873-B2 Glutamate aggrecanase inhibitors WYETH (US) 2009-06-30 US disclosed
US-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 US 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-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 FAAH 262/4885CNR2 2615/4885FFAR1 3780/4885

“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.