SCHEMBL5148408

SCHEMBL5148408

CC(C)c1cccc(C(C)C)c1-c1cc(-c2cccc(NC(=O)C(Cl)Cl)c2)on1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
ALDH1A1 P00352 4/20 0.57
MAPK1 P28482 4/20 0.57
KDM4E B2RXH2 3/20 0.57
POLB P06746 2/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
JAK3 P52333 2/20 0.47
PTPN1 P18031 2/20 0.46
PTPRA P18433 1/20 0.46
TP53 P04637 5/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL5181071 0.94 MAPT (0.67) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5150565 0.90 MAPT (0.52) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5154660 0.89 MAPT (0.52) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5852224 0.88 MAPT (0.60) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5150469 0.86 MAPT (0.75) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5154977 0.86 MAPT (0.58) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5154707 0.84 MAPT (0.68) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL14276298 0.83 MAPT (0.64) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5150488 0.83 MAPT (0.64) MAPTALDH1A1MAPK1KDM4EPOLB
SCHEMBL5141550 0.83 MAPT (0.61) MAPTALDH1A1MAPK1KDM4EPOLB

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 4321/4885ALDH1A1 733/4885MAPK1 1732/4885
US-20040236112-A1 Substituted diphenyl heterocycles useful for treating HCV infection HAVCR2, HCCS, PCNA MAPT 4524/4885ALDH1A1 984/4885MAPK1 1644/4885
US-20030165561-A1 Substituted diphenyl heterocycles useful for treating HCV infection HAVCR2, HCCS, PCNA MAPT 4524/4885ALDH1A1 984/4885MAPK1 1644/4885

“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.