SCHEMBL6584060

SCHEMBL6584060

C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC(CO)CC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.59
CCR1 P32246 2/20 0.56
CTSK P43235 6/20 0.50
CTSL P07711 4/20 0.50
CTSB P07858 4/20 0.50
CTSS P25774 2/20 0.50
CYP1A2 P05177 1/20 0.49
POLB P06746 1/20 0.49
DPP4 P27487 1/20 0.47
KCNH2 Q12809 1/20 0.47
DPP7 Q9UHL4 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CAPN1 P07384 1/20 0.47
ELANE P08246 1/20 0.46

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
SCHEMBL8329754 1.00 PREP (0.59) PREPCCR1CTSKCTSLCTSB
SCHEMBL6586390 1.00 PREP (0.59) PREPCCR1CTSKCTSLCTSB
SCHEMBL11261467 0.88 PREP (0.61) PREPCCR1CTSKCTSLCTSB
SCHEMBL8206098 0.88 PREP (0.61) PREPCCR1CTSKCTSLCTSB
SCHEMBL8206101 0.88 PREP (0.61) PREPCCR1CTSKCTSLCTSB
SCHEMBL11254461 0.88 PREP (0.61) PREPCCR1CTSKCTSLCTSB
SCHEMBL9510140 0.86 PREP (0.62) PREPCCR1CTSKCTSLCTSB
SCHEMBL7284618 0.84 BCHE (0.57) PREPCCR1CTSKCTSLCTSB
SCHEMBL7159741 0.84 ITGB3 (0.59) PREPCCR1CTSKCTSLCTSB
SCHEMBL7159739 0.84 ITGB3 (0.59) PREPCCR1CTSKCTSLCTSB

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-0815080-B1 DI-SUBSTITUTED 1,4-PIPERIDINE ESTERS AND AMIDES HAVING 5-HT4 ANTAGONISTIC ACTIVITY BOEHRINGER INGELHEIM ITALIA (IT) 2004-06-16 EP disclosed