SCHEMBL25083563

SCHEMBL25083563

CC(=O)NC(Cc1ccccc1)C(=O)NC(CCCCN)C(=O)Nc1ccc(CBr)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 2/20 0.56
▸ SSTR3 P32745 1/20 0.56
▸ GNPAT O15228 1/20 0.55
▸ CPA1 P15085 1/20 0.50
▸ CPA2 P48052 1/20 0.50
▸ CPA4 Q9UI42 1/20 0.50
▸ PSMB8 P28062 2/20 0.48
▸ PSMB11 A5LHX3 1/20 0.48
▸ PSMD11 O00231 1/20 0.48
▸ PSMD12 O00232 1/20 0.48
▸ PSMD14 O00487 1/20 0.48
▸ PSMA7 O14818 1/20 0.48
▸ PSMD3 O43242 1/20 0.48
▸ PSMC3 P17980 1/20 0.48
▸ PSMB1 P20618 1/20 0.48
▸ PSMA1 P25786 1/20 0.48
▸ PSMA2 P25787 1/20 0.48
▸ PSMA3 P25788 1/20 0.48
▸ PSMA4 P25789 1/20 0.48
▸ PSMB9 P28065 1/20 0.48

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
SCHEMBL25083560 0.91 SSTR3 (0.56) CALCRLSSTR3GNPATCPA1CPA2
SCHEMBL29550453 0.83 GNPAT (0.78) GNPATCPA1CPA2CPA4FURIN
SCHEMBL3801759 0.83 GNPAT (0.78) GNPATCPA1CPA2CPA4FURIN
SCHEMBL3801766 0.83 GNPAT (0.78) GNPATCPA1CPA2CPA4FURIN
SCHEMBL8933580 0.83 GNPAT (0.78) GNPATCPA1CPA2CPA4FURIN
SCHEMBL29368954 0.83 GNPAT (0.78) GNPATCPA1CPA2CPA4FURIN
SCHEMBL20420459 0.82 CALCRL (0.56) CALCRLSSTR3GNPATCPA1CPA2
SCHEMBL24101424 0.81 SSTR3 (0.54) CALCRLSSTR3GNPATSMN1; SMN2PLG
SCHEMBL20356791 0.81 SSTR3 (0.59) CALCRLSSTR3GNPATSMN1; SMN2
SCHEMBL12794624 0.81 GNPAT (0.58) GNPATFURIN

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
WO-2023027638-A9 POLYFLUOROPHORE NANOREPORTERS FOR FLUOROGENIC IMAGING AND EARLY DIAGNOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2023-05-11 — — WO disclosed
WO-2023027638-A2 POLYFLUOROPHORE NANOREPORTERS FOR FLUOROGENIC IMAGING AND EARLY DIAGNOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2023-03-02 — — WO disclosed
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