SCHEMBL20857438

SCHEMBL20857438

CCOC(=O)C[C@H](N)c1cccc(Oc2ccccc2OC)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ F10 P00742 2/20 0.41
▸ CARM1 Q86X55 1/20 0.41
▸ PRMT6 Q96LA8 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ F2 P00734 2/20 0.39
▸ SLC1A5 Q15758 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ GCK P35557 1/20 0.39
▸ MTNR1B P49286 2/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ CCR8 P51685 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 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
Hydrochloric Acid SCHEMBL30644985 0.99 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2KMT2AF10CARM1
Hydrochloric Acid SCHEMBL28419688 0.99 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2KMT2AF10CARM1
Hydrochloric Acid SCHEMBL28412914 0.88 KMT2A (0.44) SMN1; SMN2KMT2AF10F2PRSS1
Hydrochloric Acid SCHEMBL30644977 0.88 KMT2A (0.44) SMN1; SMN2KMT2AF10F2PRSS1
SCHEMBL31109310 0.87 CARM1 (0.48) L3MBTL1SMN1; SMN2KMT2ACARM1PRMT6
SCHEMBL20546749 0.87 PTGS1 (0.52) SMN1; SMN2KMT2AF10ALDH1A1MAPT
SCHEMBL31109331 0.87 PTGS1 (0.52) SMN1; SMN2KMT2AF10ALDH1A1MAPT
SCHEMBL13724830 0.86 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2KMT2AALDH1A1MTNR1B
Hydrochloric Acid SCHEMBL28410339 0.86 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AF10CARM1PRMT6
Hydrochloric Acid SCHEMBL30644955 0.86 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AF10CARM1PRMT6

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-20190225602-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2019-07-25 — — US disclosed
US-10246451-B2 Propionic acid derivatives and methods of use thereof AVIARA PHARMACEUTICALS, INC. (US) 2019-04-02 — — 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-10246451-B2 Propionic acid derivatives and methods of use thereof ITGA4, ITGB3, ITGB5 L3MBTL1 3880/4885SMN1; SMN2 2184/4885KMT2A 4212/4885
US-20190225602-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGA4, ITGB3, ITGB4 L3MBTL1 3328/4885SMN1; SMN2 1998/4885KMT2A 4047/4885

“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.

Send feedback