SCHEMBL6232132

SCHEMBL6232132

CCOC(=O)/C(=C/c1cccc(OC)c1)CC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 4/20 0.48
KDM4E B2RXH2 2/20 0.48
GLO1 Q04760 1/20 0.48
RECQL P46063 2/20 0.44
PTGS2 P35354 1/20 0.44
FOS P01100 1/20 0.44
JUN P05412 1/20 0.44
BCHE P06276 1/20 0.44
MTNR1B P49286 2/20 0.43
TP53 P04637 1/20 0.43
MTNR1A P48039 1/20 0.43
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
EPHX2 P34913 1/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL6232135 1.00 MAPT (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL6232140 1.00 MAPT (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL9023562 0.89 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL9023565 0.89 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
Benzene SCHEMBL27424700 0.89 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL3540128 0.88 MAPT (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL3540131 0.88 MAPT (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL7379252 0.87 SMN1; SMN2 (0.46) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL13082048 0.85 TLR4 (0.47) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL25410057 0.85 KMT2A (0.51) MAPTMEN1KMT2AALDH1A1LMNA

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-20090281154-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2009-11-12 US disclosed
US-20090281154-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2009-11-12 US disclosed
WO-2007146136-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2007-12-21 WO disclosed
EP-0888301-B1 MCBI ANALOGS OF CC-1065 AND THE DUOCARMYCINS SCRIPPS RESEARCH INST (US) 2005-08-10 EP disclosed
US-5985908-A MCBI (7-METHOXY-1,2,9A-TETRA-HYDROCYCLOPROPA(C)BENZ(E)INDOL-4-ONE) IS EMPLOYABLE AS A DNA ALKYLATING AGENT AND CAN BE INCORPORATED INTO ANALOGS OF CC-1065 AND THE DUOCARMYCINS FOR THE SCRIPPS RESEARCH INSTITUTE (US) 1999-11-16 US disclosed
US-5308852-A Cardiovascular disorders MERCK FROSST CANADA, INC. (CA) 1994-05-03 US disclosed
EP-0579304-A1 Heteroarylnaphthalenes as inhibitors of leukotriene biosynthesis MERCK FROSST CANADA INC. (CA) 1994-01-19 EP 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-20090281154-A1 Ophthalmic Compositions for Treating Ocular Hypertension KCNN1, KCNN3, KCNN2 MAPT 1089/4885MEN1 1259/4885KMT2A 2607/4885

“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.