SCHEMBL20546217

SCHEMBL20546217

CCOC(=O)CC(NC(c1ccccc1)(c1ccccc1)c1ccccc1)c1cccc(-c2cc(Cl)c(F)cc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
THRB P10828 1/20 0.40
PTGS2 P35354 1/20 0.37
CTSA P10619 4/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
AKR1C3 P42330 2/20 0.35
AKR1C2 P52895 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
PTPRC P08575 1/20 0.33
PTPN2 P17706 1/20 0.33
PTPN1 P18031 1/20 0.33
PTPA Q15257 1/20 0.33

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
SCHEMBL20546411 0.80 CTSA (0.39) MAPTTHRBPTGS2CTSAAKR1C3
SCHEMBL28368408 0.79 MAPT (0.44) MAPTTHRBCTSAALDH1A1SMN1; SMN2
SCHEMBL20546387 0.79 LMNA (0.40) MAPTCTSAL3MBTL1MEN1KMT2A
SCHEMBL20546321 0.78 MAPT (0.40) MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL20546057 0.78 F10 (0.39) MAPTALDH1A1SMN1; SMN2
SCHEMBL20545644 0.77 NPSR1 (0.42) MAPTCTSAALDH1A1SMN1; SMN2
SCHEMBL20546631 0.74 LMNA (0.37) MAPTALDH1A1SMN1; SMN2RAB9A
SCHEMBL20546553 0.74 FAAH (0.40) MAPTALDH1A1SMN1; SMN2L3MBTL1MEN1
SCHEMBL20545886 0.73 PTGDR2 (0.41) MAPTCTSAALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL29219908 0.73 MAPT (0.34) MAPTCTSAALDH1A1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615514-B1 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS INC (US) 2023-11-22 EP disclosed
US-10875875-B2 Propionic acid derivatives and methods of use thereof AVIARA PHARMACEUTICALS, INC. (US) 2020-12-29 US disclosed
EP-3615514-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF Aviara Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed
US-20180312523-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 US disclosed
WO-2018201167-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 WO 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-20180312523-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGB3, ITGA1, ITGB5 MAPT 3961/4885THRB 236/4885PTGS2 2499/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 MAPT 3961/4885THRB 236/4885PTGS2 2499/4885

“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.