SCHEMBL5373095

SCHEMBL5373095

CC(C)c1cc(C=C(C#N)S(=O)(=O)NCCCc2ccccc2)cc(C(C)C)c1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
KDR P35968 1/20 0.67
EGFR P00533 5/20 0.44
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
ALDH1A1 P00352 4/20 0.43
TDP1 Q9NUW8 4/20 0.43
CYP2D6 P10635 4/20 0.43
KDM4E B2RXH2 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
HPGD P15428 3/20 0.43
ALOX15 P16050 3/20 0.43
ALOX12 P18054 3/20 0.43
MAPK1 P28482 3/20 0.43
RECQL P46063 3/20 0.43
BLM P54132 3/20 0.43
HSD17B10 Q99714 3/20 0.43
CYP2C19 P33261 3/20 0.43

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
SCHEMBL5373092 1.00 MAPT (0.67) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5373087 1.00 MAPT (0.67) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5365163 0.87 SMN1; SMN2 (0.53) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5365160 0.87 SMN1; SMN2 (0.53) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5365166 0.87 SMN1; SMN2 (0.53) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5367793 0.86 MAPT (0.49) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5367797 0.86 MAPT (0.49) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5367801 0.86 MAPT (0.49) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5371066 0.84 MAPT (0.47) MAPTSMN1; SMN2KDREGFRKMT2A
SCHEMBL5371078 0.84 MAPT (0.47) MAPTSMN1; SMN2KDREGFRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5789427-A ANTITUMOR, ANTICANCER AGENTS SUGEN, INC. (US) 1998-08-04 US claimed
US-7217737-B2 Method and compositions for inhibiting cell proliferative disorders YISSUM RESEARCH AND DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2007-05-15 US disclosed
US-20040242684-A1 Method and compositions for inhibiting cell proliferative disorders YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM 2004-12-02 US disclosed
US-6596878-B2 Protein kinase inhibitor compositio; used to treat cell proliferative disorders such as cancers charcterized by over-activity or inappropriate activity HER2 or EGFR. YISSUM RESEARCH & DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY (IL) 2003-07-22 US disclosed
US-20020068687-A1 Methods and compositions for inhibiting cell proliferative disorders CHEN HUI (US) 2002-06-06 US disclosed
US-6225346-B1 FOR THERAPY AND PROPHYLAXIS OF CELL PROLIFERATIVE DISORDERS OR CELL DIFFERENTIATION DISORDERS ASSOCIATED WITH PARTICULAR TYROSINE KINASES BY INHIBITING ONE OR MORE ABNORMAL TYROSINE KINASE ACTIVITIES SUGEN, INC. 2001-05-01 US disclosed
US-5935993-A TYROSINE KINASE INHIBITORS; TREATMENT OF CELL GROWTH, CELL DIFFERENTIATION DISORDERS SUGEN, INC. (US) 1999-08-10 US disclosed
US-5891917-A MODULATING TYROSINE SIGNAL TRANSDUCTION TO PREVENT AND TREAT CELL PROLIFERATIVE DISORDERS OR CELL DIFFERENTIATION DISORDERS ASSOCIATED WITH PARTICULAR TYROSINE KINASES BY INHIBITING ONE OR MORE ABNORMAL TYROSINE KINASE ACTIVITIES SUGEN, INC. (US) 1999-04-06 US disclosed
US-5789427-A ANTITUMOR, ANTICANCER AGENTS SUGEN, INC. (US) 1998-08-04 US disclosed
US-5773476-A KINASE INHIBITORS SUGEN, INC. (IL) 1998-06-30 US disclosed
WO-1996040629-A1 TYRPHOSTIN-LIKE COMPOUNDS FOR THE TREATMENT OF CELL PROLIFERATIVE DISORDERS OR CELL DIFFERENTIATION DISORDERS SUGEN, INC. (US) 1996-12-19 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 (1 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-20040242684-A1 Method and compositions for inhibiting cell proliferative disorders ERBB2, EGFR, MKI67 MAPT 2232/4885SMN1; SMN2 3362/4885KDR 396/4885

“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.