SCHEMBL24585291

SCHEMBL24585291

Cc1ccc(NC(=O)NCCCCC(NC(=O)NCC(=O)O)C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 14/20 0.63
▸ SLC6A3 Q01959 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.51
▸ CASR P41180 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ FPR2 P25090 1/20 0.45
▸ TGM2 P21980 1/20 0.45

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
SCHEMBL20312183 1.00 FOLH1 (0.63) FOLH1SLC6A3ALDH1A1CASRCYP1A2
SCHEMBL19756821 0.91 FOLH1 (0.69) FOLH1SLC6A3ALDH1A1CASRCYP1A2
SCHEMBL20312213 0.89 FOLH1 (0.78) FOLH1ALDH1A1
SCHEMBL22840014 0.89 FOLH1 (0.78) FOLH1ALDH1A1
SCHEMBL22840039 0.88 FOLH1 (0.79) FOLH1ALDH1A1FPR2
SCHEMBL22840031 0.88 FOLH1 (0.79) FOLH1SLC6A3CASR
SCHEMBL20312202 0.88 FOLH1 (0.79) FOLH1SLC6A3CASR
SCHEMBL20312237 0.88 FOLH1 (0.79) FOLH1ALDH1A1FPR2
SCHEMBL11977629 0.88 FOLH1 (0.80) FOLH1SLC6A3
SCHEMBL11977616 0.88 FOLH1 (0.80) FOLH1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3699162-B1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARM INC (US) 2022-06-29 — — EP disclosed
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