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SCHEMBL7574524

SCHEMBL7574524

CC(C)(C)OP(=O)(OC(C)(C)C)C(F)(F)c1ccc(CC(Cc2ccc(C(C(C)(C)C)(C(C)(C)C)P(=O)(OF)OF)c(Br)c2)(C(=O)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 15/20 0.50
▸ PTPRC P08575 3/20 0.41
▸ PTPN2 P17706 4/20 0.37
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 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
SCHEMBL7165440 0.90 PTPN1 (0.56) PTPN1PTPRCPTPN2MEN1LMNA
SCHEMBL7886821 0.84 PTPN1 (0.70) PTPN1PTPRCPTPN2
SCHEMBL6852050 0.82 PTPN1 (0.47) PTPN1PTPRCPTPN2
SCHEMBL6948682 0.79 PTPN1 (0.63) PTPN1PTPRCPTPN2
SCHEMBL6948156 0.78 PTPN1 (0.60) PTPN1PTPRCPTPN2MEN1MAPT
SCHEMBL7165563 0.77 PTPN1 (0.77) PTPN1PTPRCPTPN2
SCHEMBL7165292 0.75 PTPN1 (0.69) PTPN1PTPRCPTPN2
SCHEMBL7165444 0.75 PTPN1 (0.55) PTPN1PTPRCPTPN2
SCHEMBL6850495 0.75 PTPN1 (0.68) PTPN1PTPRCPTPN2
SCHEMBL6852052 0.75 PTPN1 (0.49) PTPN1PTPRCPTPN2

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-1242432-A1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B (PTP-1B) MERCK FROSST CANADA INC. (CA) 2002-09-25 — — EP disclosed
WO-2001046205-A1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B (PTP-1B) MERCK FROSST CANADA & CO. (CA) 2001-06-28 — — WO disclosed