SCHEMBL21459622

SCHEMBL21459622

Cc1cc(F)cc(C)c1-c1cccc([C@@H](N)CC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
FFAR1 O14842 6/20 0.44
CTSA P10619 13/20 0.42

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
SCHEMBL21459626 1.00 KMT2A (0.45) KMT2ASMN1; SMN2FFAR1CTSA
SCHEMBL20545501 0.90 FFAR1 (0.51) KMT2ASMN1; SMN2FFAR1CTSA
SCHEMBL20545503 0.90 FFAR1 (0.51) KMT2ASMN1; SMN2FFAR1CTSA
Hydrochloric Acid SCHEMBL28510787 0.89 FFAR1 (0.50) KMT2ASMN1; SMN2FFAR1CTSA
SCHEMBL20546148 0.85 CTSA (0.47) FFAR1CTSA
SCHEMBL20546150 0.85 CTSA (0.47) FFAR1CTSA
SCHEMBL21476145 0.85 TRPM8 (0.38) SMN1; SMN2FFAR1CTSA
SCHEMBL20545404 0.83 KMT2A (0.49) KMT2ASMN1; SMN2CTSA
SCHEMBL20546003 0.83 KMT2A (0.49) KMT2ASMN1; SMN2FFAR1CTSA
SCHEMBL20545405 0.83 KMT2A (0.49) KMT2ASMN1; SMN2CTSA

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
US-11174228-B2 Antagonists of human integrin (α4)(β7) MORPHIC THERAPEUTIC, INC. (US) 2021-11-16 US disclosed
EP-3773573-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) Morphic Therapeutic, Inc. (US) 2021-02-17 EP disclosed
US-20200385352-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) MORPHIC THERAPEUTIC, INC. 2020-12-10 US disclosed
US-10759756-B2 Antagonists of human integrin α4β7 MORPHIC THERAPEUTIC, INC. (US) 2020-09-01 US disclosed
US-20190315692-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) MORPHIC THERAPEUTIC, INC. 2019-10-17 US disclosed
WO-2019200202-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) MORPHIC THERAPEUTIC, INC. (US) 2019-10-17 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 (4 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-20190315692-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) ITGB7, ITGB4, ITGA4 KMT2A 4210/4885SMN1; SMN2 2490/4885FFAR1 2643/4885
US-11174228-B2 Antagonists of human integrin (α4)(β7) ITGB7, ITGB4, ITGA4 KMT2A 4095/4885SMN1; SMN2 2406/4885FFAR1 2655/4885
US-20200385352-A1 ANTAGONISTS OF HUMAN INTEGRIN (ALPHA4)(BETA7) ITGB7, ITGB4, ITGA4 KMT2A 4210/4885SMN1; SMN2 2490/4885FFAR1 2643/4885
US-10759756-B2 Antagonists of human integrin α4β7 ITGB7, ITGB4, ITGA4 KMT2A 3945/4885SMN1; SMN2 1921/4885FFAR1 2927/4885

“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.