SCHEMBL5837575

SCHEMBL5837575

Cc1cc(C)c(N=Cc2ccccc2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
LIG1 P18858 2/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
KDM4E B2RXH2 2/20 0.42
GLA P06280 2/20 0.42
G6PD P11413 1/20 0.40
PTGS2 P35354 2/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL11048071 1.00 ALDH1A1 (0.46) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL12379904 0.83 L3MBTL1 (0.46) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL18489660 0.83 L3MBTL1 (0.46) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL18489661 0.83 L3MBTL1 (0.46) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL11415401 0.79 CA2 (0.57) ALDH1A1CA1CA2KDM4EGLA
SCHEMBL11275875 0.78 LMNA (0.41) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL11275872 0.78 LMNA (0.41) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL14337301 0.77 KDM4E (0.52) ALDH1A1L3MBTL1LMNALIG1CA1
SCHEMBL14821445 0.76 ALDH1A1 (0.41) ALDH1A1L3MBTL1LMNACA1CA2
SCHEMBL445024 0.75 ALDH1A1 (0.61) ALDH1A1L3MBTL1LMNACA1CA2

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
US-7060768-B2 Polymerization of olefinic compounds E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-06-13 US disclosed
US-20040158012-A1 Polymerization of olefinic compounds BROOKHART MAURICE S (US) 2004-08-12 US disclosed
US-6710007-B2 TRANSITION METAL COMPLEXES OF IMINES, AMINES OR PHOSPHINES CONTAINING ESTERS OR AMIDES E. I. DU PONT DE NEMOURS AND COMPANY 2004-03-23 US disclosed
EP-1355956-A2 POLYMERIZATION OF OLEFINIC COMPOUNDS E.I. Dupont de Nemours and Company (US) 2003-10-29 EP disclosed
US-20030125485-A1 Polymerization of olefinic compounds NORTH CAROLINA AT CHAPEL HILL, UNIVERSITY OF 2003-07-03 US disclosed
WO-2002059165-A2 POLYMERIZATION OF OLEFINIC COMPOUNDS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2002-08-01 WO disclosed
US-4473579-A REDUCING CHOLESTEROL ESTER CONTENT IN ARTERIES AMERICAN CYANAMID COMPANY (US) 1984-09-25 US 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-20030125485-A1 Polymerization of olefinic compounds PORCN, PHOSPHO1, TEC ALDH1A1 2253/4885L3MBTL1 3233/4885LMNA 3756/4885

“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.