SCHEMBL20546802

SCHEMBL20546802

Cc1cccc(Cc2cccc(C(N)CC(=O)O)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
FFAR1 O14842 1/20 0.44
CYP26A1 O43174 1/20 0.43
CTBP2 P56545 1/20 0.41
CTSA P10619 1/20 0.40
ANPEP P15144 1/20 0.40
ENPEP Q07075 1/20 0.40
ACP3 P15309 1/20 0.40
KIF11 P52732 3/20 0.39
TAAR1 Q96RJ0 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSS P25774 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
SCHEMBL20546800 1.00 KMT2A (0.54) KMT2ASMN1; SMN2FFAR1CYP26A1CTBP2
SCHEMBL20546879 0.90 KMT2A (0.53) KMT2ASMN1; SMN2ANPEPENPEPALDH1A1
SCHEMBL20546880 0.90 KMT2A (0.53) KMT2ASMN1; SMN2ANPEPENPEPALDH1A1
SCHEMBL20546865 0.90 KMT2A (0.47) KMT2ASMN1; SMN2FFAR1CYP26A1CTBP2
SCHEMBL20546868 0.90 KMT2A (0.47) KMT2ASMN1; SMN2FFAR1CYP26A1CTBP2
SCHEMBL20546782 0.88 KMT2A (0.63) KMT2ASMN1; SMN2ANPEPENPEP
SCHEMBL20546784 0.88 KMT2A (0.63) KMT2ASMN1; SMN2ANPEPENPEP
SCHEMBL2858374 0.88 KMT2A (0.55) KMT2ASMN1; SMN2FFAR1CYP26A1CTSA
SCHEMBL3510648 0.88 KMT2A (0.55) KMT2ASMN1; SMN2FFAR1CYP26A1CTSA
SCHEMBL27347770 0.88 KMT2A (0.55) KMT2ASMN1; SMN2FFAR1CYP26A1CTSA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914241-A Propionic acid derivatives and methods of use thereof 阿维亚拉药品有限公司 2020-03-24 CN disclosed
EP-3615515-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF Aviara Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed
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
WO-2018209363-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS, INC (US) 2018-11-15 WO disclosed
US-20180312498-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 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 (3 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 KMT2A 4212/4885SMN1; SMN2 2184/4885FFAR1 57/4885
US-20190225602-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGA4, ITGB3, ITGB4 KMT2A 4047/4885SMN1; SMN2 1998/4885FFAR1 61/4885
US-20180312498-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGA4, ITGB3, ITGB5 KMT2A 4212/4885SMN1; SMN2 2184/4885FFAR1 57/4885

“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.