SCHEMBL5152880

SCHEMBL5152880

O=C(Nc1cccc(-c2cc(-c3c(F)cccc3C(F)(F)F)no2)c1)C(Cl)Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 2/20 0.49
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPK1 P28482 1/20 0.49
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PDK1 Q15118 1/20 0.43
JAK3 P52333 1/20 0.42
TP53 P04637 3/20 0.41
RORC P51449 2/20 0.40
PTPN1 P18031 2/20 0.39
PTPRA P18433 1/20 0.39
LMNA P02545 1/20 0.39
XBP1 P17861 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RAF1 P04049 1/20 0.36
BRAF P15056 1/20 0.36

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
SCHEMBL5183597 0.90 MAPT (0.51) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL3802836 0.90 MAPT (0.40) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5153135 0.89 MAPT (0.53) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5150565 0.89 MAPT (0.52) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5150476 0.87 MAPT (0.65) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5154574 0.87 MAPT (0.50) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL3802829 0.87 PDK1 (0.42) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5150709 0.86 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5150748 0.86 MAPT (0.53) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL5150405 0.86 MAPT (0.48) MAPTMEN1KMT2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451162-A4 SUBSTITUTED DIPHENYL HETEROCYCLES USEFUL FOR TREATING HCV INFECTION RIGEL PHARMACEUTICALS INC (US) 2007-02-07 EP disclosed
US-7153880-B2 Substituted diphenyl heterocycles useful for treating HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2006-12-26 US disclosed
US-7115642-B2 Substituted diphenyl isoxazoles, pyrazoles and oxadiazoles useful for treating HCV infection RIGEL PHARMACEUTICALS, INC. (US) 2006-10-03 US disclosed
US-20040266840-A1 Substituted diphenyl isoxazoles, pyrazoles and oxadiazoles useful for treating HCV infection MIDCAP FINANCIAL TRUST 2004-12-30 US disclosed
US-20040236112-A1 Substituted diphenyl heterocycles useful for treating HCV infection MIDCAP FINANCIAL TRUST 2004-11-25 US disclosed
WO-2004099164-A1 SUBSTITUTED DIPHENYL ISOXAZOLES, PYRAZOLES AND OXADIAZOLES USEFUL FOR TREATING HCV INFECTION RIGEL PHARMACEUTICALS, INC. (US) 2004-11-18 WO disclosed
EP-1451162-A1 SUBSTITUTED DIPHENYL HETEROCYCLES USEFUL FOR TREATING HCV INFECTION Rigel Pharmaceuticals, Inc. (US) 2004-09-01 EP disclosed
US-6759538-B2 PREVENTION INFECTIONS OF HEPATITIS C VIRUS RIGEL PHARMACEUTICALS, INC. 2004-07-06 US disclosed
US-20030165561-A1 Substituted diphenyl heterocycles useful for treating HCV infection MIDCAP FINANCIAL TRUST 2003-09-04 US disclosed
WO-2003040112-A1 SUBSTITUTED DIPHENYL HETEROCYCLES USEFUL FOR TREATING HCV INFECTION RIGEL PHARMACEUTICALS, INC. (US) 2003-05-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040266840-A1 Substituted diphenyl isoxazoles, pyrazoles and oxadiazoles useful for treating HCV infection HAVCR2, MAVS, RPL35 MAPT 4321/4885MEN1 4877/4885KMT2A 4311/4885
US-20040236112-A1 Substituted diphenyl heterocycles useful for treating HCV infection HAVCR2, HCCS, PCNA MAPT 4524/4885MEN1 4717/4885KMT2A 3366/4885
US-20030165561-A1 Substituted diphenyl heterocycles useful for treating HCV infection HAVCR2, HCCS, PCNA MAPT 4524/4885MEN1 4717/4885KMT2A 3366/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.