SCHEMBL20006910

SCHEMBL20006910

COc1ccc(CC(=O)N2C(=O)OC[C@H]2Cc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.44
OXTR P30559 1/20 0.43
MTNR1A P48039 3/20 0.42
MTNR1B P49286 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 2/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL19999725 0.89 NAAA (0.42) PDE4BCSNK2BCSNK2A1FAAH
SCHEMBL4515994 0.83 SIGMAR1 (0.47) KDM4EALDH1A1CSNK2BCSNK2A1KMT2A
SCHEMBL4510525 0.83 SIGMAR1 (0.47) KDM4EALDH1A1CSNK2BCSNK2A1KMT2A
SCHEMBL4685201 0.83 SIGMAR1 (0.47) KDM4EALDH1A1CSNK2BCSNK2A1KMT2A
SCHEMBL17186412 0.82 FAAH (0.48) CSNK2BCSNK2A1KMT2AFAAH
SCHEMBL7423431 0.82 FAAH (0.48) CSNK2BCSNK2A1KMT2AFAAH
SCHEMBL1153166 0.82 ALDH1A1 (0.48) ALDH1A1KMT2AFAAH
SCHEMBL4515997 0.82 ALDH1A1 (0.48) ALDH1A1KMT2AFAAH
SCHEMBL2370627 0.82 ALDH1A1 (0.48) ALDH1A1KMT2AFAAH
SCHEMBL3305638 0.82 KDM4E (0.45) PDE4BOXTRKDM4EALDH1A1GAA

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-10385061-B2 Medicarpin, its derivatives, manufacturing method thereof PHYTOHEALTH CORPORATION (TW) 2019-08-20 US disclosed
US-20180086772-A1 MEDICARPIN, ITS DERIVATIVES, MANUFACTURING METHOD THEREOF PHYTOHEALTH CORPORATION (TW) 2018-03-29 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 (2 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-20180086772-A1 MEDICARPIN, ITS DERIVATIVES, MANUFACTURING METHOD THEREOF SHARPIN, TIPARP, MYADM PDE4B 752/4885OXTR 4805/4885MTNR1A 640/4885
US-10385061-B2 Medicarpin, its derivatives, manufacturing method thereof SHARPIN, ATP6V1B1, REN PDE4B 658/4885OXTR 4715/4885MTNR1A 1279/4885

“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.