SCHEMBL29687069

SCHEMBL29687069

COc1cccc(NC(=O)NC(Cc2ccccc2)C(N)=O)c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 2/20 0.62
▸ CA12 O43570 1/20 0.59
▸ CA1 P00915 1/20 0.59
▸ CA2 P00918 1/20 0.59
▸ CA9 Q16790 1/20 0.59
▸ USP2 O75604 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ RAB9A P51151 3/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ CRHBP P24387 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ THRB P10828 1/20 0.54
▸ CASR P41180 1/20 0.54
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ MAPT P10636 1/20 0.53

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
SCHEMBL29687123 0.87 FPR2 (0.81) FPR2CA12CA1CA2CA9
SCHEMBL29686977 0.84 CA12 (0.56) FPR2CA12CA1CA2CA9
SCHEMBL20335073 0.84 MEN1 (0.61) FPR2CA12CA1CA2CA9
SCHEMBL11579877 0.84 USP2 (0.61) FPR2USP2RAB9AKMT2ACRHBP
SCHEMBL29686493 0.84 FPR2 (0.63) FPR2CA12CA1CA2CA9
SCHEMBL20611567 0.84 FPR2 (0.63) FPR2CA12CA1CA2CA9
SCHEMBL5842757 0.80 CTSL (0.67) FPR2LMNAALDH1A1ALOX15
SCHEMBL5842766 0.80 CTSL (0.67) FPR2LMNAALDH1A1ALOX15
SCHEMBL20241469 0.80 TAAR1 (0.54) ALDH1A1POLBKMT2AMEN1SMN1; SMN2
SCHEMBL14026537 0.80 MEN1 (0.53) RAB9AALDH1A1KMT2ATHRBMEN1

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-3265083-B1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE ST JUDE CHILDRENS RES HOSPITAL (US) 2022-07-06 — — EP disclosed
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