SCHEMBL569702

SCHEMBL569702

Cc1cc(-c2[nH]nc(C(=O)O)c2C)c(C)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 2/20 0.47
▸ HCAR2 Q8TDS4 5/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ CCNE2 O96020 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CDK4 P11802 3/20 0.36
▸ CCND1 P24385 3/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.34
▸ DAO P14920 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32

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
SCHEMBL570062 0.69 PIN1 (0.47) HCAR2KDM4ESMN1; SMN2ALDH1A1NPSR1
SCHEMBL569692 0.69 HCAR2 (0.41) HCAR2DAO
SCHEMBL4740858 0.67 PRKAB2 (0.50) —
SCHEMBL570152 0.67 HCAR2 (0.45) HCAR2DAOTSHR
SCHEMBL569780 0.67 BRD4 (0.48) HCAR2KDM4EDAO
SCHEMBL570366 0.67 KMT2A (0.49) HCAR2KDM4ECCNE2CCNE1CDK2
SCHEMBL27658275 0.67 HAO2 (0.54) HCAR2KDM4E
SCHEMBL16197762 0.66 ALPL (0.46) HCAR2KDM4ESMN1; SMN2MAPTPOLB
SCHEMBL4964605 0.66 HAO2 (0.53) HCAR2MAPT
SCHEMBL2198685 0.65 IKBKB (0.43) HCAR2KDM4ESMN1; SMN2ALDH1A1MAPT

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
EP-2601208-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY Graffinity Pharmaceuticals GmbH (DE) 2013-06-12 — — EP disclosed
WO-2012017021-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-09 — — WO disclosed
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