SCHEMBL11374075

SCHEMBL11374075

CCCC(=O)OCCOC(=O)Cc1sccc1Nc1cccc(Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ ABCB11 O95342 1/20 0.38
▸ DGAT2 Q96PD7 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TTR P02766 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TBXA2R P21731 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MAPT P10636 4/20 0.36
▸ POLB P06746 2/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HTT P42858 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL11367938 0.81 ALDH1A1 (0.45) KMT2AMEN1ABCB11USP2LMNA
SCHEMBL11374604 0.78 CXCL8 (0.51) KMT2AMEN1ABCB11LMNATTR
SCHEMBL11373706 0.77 CXCL8 (0.43) KMT2AMEN1USP2LMNATTR
SCHEMBL11366409 0.76 TTR (0.50) KMT2AMEN1ABCB11USP2LMNA
SCHEMBL11380072 0.73 PTGS2 (0.52) KMT2AMEN1ABCB11USP2LMNA
SCHEMBL11380719 0.73 PHGDH (0.30) —
SCHEMBL11387892 0.72 CXCL8 (0.48) KMT2AABCB11USP2LMNATTR
SCHEMBL11370538 0.72 PTGS2 (0.48) KMT2AMEN1ABCB11USP2LMNA
SCHEMBL11386345 0.70 MEN1 (0.38) KMT2AMEN1ABCB11LMNACYP2C9
SCHEMBL11368848 0.69 ALDH1A1 (0.42) KMT2AUSP2LMNATTRCYP2C9

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-4272507-A Phenylaminothiophenacetic acids, their synthesis, compositions and use BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1981-06-09 — — US disclosed
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