SCHEMBL29663619

SCHEMBL29663619

N[C@@](Cc1ccc(Cl)cc1Cl)(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 3/20 0.44
▸ FABP7 O15540 2/20 0.44
▸ KMT2A Q03164 3/20 0.40
▸ P2RX7 Q99572 2/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ GGPS1 O95749 1/20 0.37
▸ TBXA2R P21731 1/20 0.37
▸ PTGFR P43088 1/20 0.37
▸ PTGER3 P43115 1/20 0.37
▸ PTGER2 P43116 1/20 0.37
▸ PTGIR P43119 1/20 0.37
▸ PTGDR Q13258 1/20 0.37
▸ ACLY P53396 2/20 0.37
▸ EPHX1 P07099 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35

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
SCHEMBL17513346 0.85 FABP7 (0.40) FABP5FABP7KMT2AP2RX7EPHX2
SCHEMBL17513203 0.85 FABP5 (0.39) FABP5FABP7KMT2AP2RX7EPHX2
SCHEMBL16634841 0.84 SMN1; SMN2 (0.46) FABP5FABP7KMT2AEPHX2CYP1A2
SCHEMBL17799057 0.81 FABP5 (0.45) FABP5FABP7KMT2AEPHX2TBXA2R
SCHEMBL27522574 0.80 SMN1; SMN2 (0.55) FABP5FABP7KMT2AEPHX2TP53
SCHEMBL29019464 0.80 SMN1; SMN2 (0.55) FABP5FABP7KMT2AEPHX2TP53
SCHEMBL5264305 0.80 SMN1; SMN2 (0.55) FABP5FABP7KMT2AEPHX2TP53
SCHEMBL28719512 0.77 KMT2A (0.52) FABP5FABP7KMT2AEPHX2TP53
SCHEMBL4388219 0.77 KMT2A (0.52) FABP5FABP7KMT2AEPHX2TP53
SCHEMBL27587876 0.77 KMT2A (0.49) FABP5FABP7KMT2AEPHX2TP53

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-20220185846-A1 METHODS FOR SYNTHESIZING BETA-HOMOAMINO ACIDS PROTAGONIST THERAPEUTICS, INC. 2022-06-16 — — US disclosed
US-20220162261-A1 NOVEL a4B7 PEPTIDE MONOMER AND DIMER ANTAGONISTS PROTAGONIST THERAPEUTICS, INC. 2022-05-26 — — 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-20220185846-A1 METHODS FOR SYNTHESIZING BETA-HOMOAMINO ACIDS PSMA7, ITGB7, SCN7A FABP5 1359/4885FABP7 61/4885KMT2A 2305/4885
US-20220162261-A1 NOVEL a4B7 PEPTIDE MONOMER AND DIMER ANTAGONISTS EPCAM, VCAM1, ITGB7 FABP5 583/4885FABP7 139/4885KMT2A 4212/4885

“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.

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