SCHEMBL7680102

SCHEMBL7680102

CC(=O)Oc1ccccc1CNCC1Cc2c(sc(NC(=O)C(=O)O)c2C(=O)O)CO1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.44
RAB7A P51149 3/20 0.42
PTPN2 P17706 7/20 0.41
PTPRC P08575 2/20 0.40
PTPRB P23467 2/20 0.40
PTPRE P23469 2/20 0.40
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
PTPN6 P29350 1/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL5837862 0.92 PTPN1 (0.45) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6317112 0.85 PTPN1 (0.44) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6317331 0.80 SMN1; SMN2 (0.45) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL7676326 0.78 PTPN1 (0.49) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6206528 0.77 RAB7A (0.55) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6322930 0.75 PTPN1 (0.47) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6316036 0.75 PTPN1 (0.47) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6323697 0.75 PTPN1 (0.45) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6395534 0.75 SMN1; SMN2 (0.50) PTPN1RAB7APTPN2PTPRCPTPRB
SCHEMBL6316713 0.75 RAB7A (0.45) PTPN1RAB7APTPN2PTPRCPTPRB

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
US-6410586-B1 ANTICOAGULANTS; INSULIN RESISTANCE; ANTIALLERGENS NOVO NORDISK A/S (DK) 2002-06-25 US claimed