SCHEMBL8151733

SCHEMBL8151733

O=P(O)(O)c1cccc(OCc2ccc3ccccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.50
▸ TLR4 O00206 1/20 0.50
▸ TLR2 O60603 1/20 0.50
▸ MRGPRX4 Q96LA9 1/20 0.50
▸ PTPN2 P17706 1/20 0.50
▸ PTPN1 P18031 1/20 0.50
▸ PTPRB P23467 1/20 0.50
▸ PTPN6 P29350 1/20 0.50
▸ PTPN11 Q06124 1/20 0.50
▸ F2 P00734 2/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ ALOX5 P09917 5/20 0.47
▸ TDP1 Q9NUW8 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
SCHEMBL22480904 0.89 MRGPRX4 (0.60) RAB9ATLR4TLR2MRGPRX4PTPN2
SCHEMBL27408465 0.85 NR4A2 (0.58) RAB9APTPN2PTPN1PTPRBPTPN6
SCHEMBL26162714 0.82 F10 (0.51) RAB9AMRGPRX4PTPN2PTPN1PTPRB
SCHEMBL8157153 0.81 TLR4 (0.46) RAB9ATLR4TLR2NPC1ALOX5
SCHEMBL8499678 0.81 ALOX5 (0.43) RAB9ATLR4TLR2MRGPRX4PTPN2
SCHEMBL27430217 0.77 MEN1 (0.47) RAB9APTPN1NPC1MAPTTDP1
SCHEMBL12938497 0.76 ALOX5 (0.78) RAB9ATLR4TLR2MRGPRX4F2
SCHEMBL8994871 0.76 RAB9A (0.67) RAB9ATLR4TLR2MRGPRX4F2
SCHEMBL27903712 0.75 SMPD1 (0.59) RAB9AMRGPRX4F2NPC1MAPT
SCHEMBL4638462 0.74 F2 (0.68) MRGPRX4F2NPC1MAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2000511883-A — — 2000-09-12 — — JP claimed
WO-1997040017-A2 MODULATORS OF MOLECULES WITH PHOSPHOTYROSINE RECOGNITION UNITS NOVO NORDISK A/S (DK) 1997-10-30 — — WO claimed
US-6080770-A SUBSTITUTED 1,2,3-TRIAZOLE OR 1,2,4-TRIAZOLE COMPOUND NOVO NORDISK A/S (DK) 2000-06-27 — — US disclosed
US-6063800-A Modulators of molecules with phosphotyrosine recognition units NOVO NORDISK A/S (DK) 2000-05-16 — — US disclosed
US-5972978-A FOR USE IN TREATMENT OF HUMAN AND ANIMAL DISORDERS, USE FOR PURIFICATION OF PROTEINS OR GLYCOPROTEINS, USE IN DIAGNOSIS NOVO NORDISK A/S (DK) 1999-10-26 — — US disclosed
US-5958957-A PROTEIN TYROSINE PHOSPHATASES, PROTEINS WITH SRC-MONOLOGY 2-DOMAINS; ANTICARCINOGENIC,-TUMOR AND DIABETIC AGENTS; PURIFICATION OF PROTEINS AND GLYCOPROTEINS; MEDICAL DIAGNOSIS NOVO NORDISK A/S (DK) 1999-09-28 — — US disclosed
WO-1997040017-A2 MODULATORS OF MOLECULES WITH PHOSPHOTYROSINE RECOGNITION UNITS NOVO NORDISK A/S (DK) 1997-10-30 — — WO disclosed
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