SCHEMBL1967499

SCHEMBL1967499

CCOC(=O)Cc1coc(/C=C/c2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.46
MAPT P10636 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ERBB2 P04626 2/20 0.42
TP53 P04637 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
GRM4 Q14833 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
SCHEMBL1967501 1.00 ALDH1A1 (0.51) ALDH1A1LMNAMAPTCTDSP1KDM4E
SCHEMBL3408982 0.92 ALDH1A1 (0.50) ALDH1A1LMNAMAPTCTDSP1KDM4E
SCHEMBL740361 0.81 ADORA3 (0.49) ALDH1A1LMNAMAPTCTDSP1KDM4E
SCHEMBL740362 0.81 ADORA3 (0.49) ALDH1A1LMNAMAPTCTDSP1KDM4E
SCHEMBL14523934 0.79 ERBB2 (0.50) MAPTSMN1; SMN2ERBB2CYP2C19
SCHEMBL5758992 0.79 CYP4F2 (0.42) ALDH1A1MAPTCTDSP1KDM4EPOLB
SCHEMBL5763599 0.79 FFAR1 (0.53) ERBB2
SCHEMBL5758996 0.79 CYP4F2 (0.42) ALDH1A1MAPTCTDSP1KDM4EPOLB
SCHEMBL5763596 0.79 FFAR1 (0.53) ERBB2
SCHEMBL5761110 0.79 CYP4F2 (0.43) ALDH1A1MAPTCTDSP1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
US-20110166121-A1 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2011-07-07 US disclosed
EP-2334689-A2 FUSED HETEROCYCLIC COMPOUND LG Life Sciences Ltd. (KR) 2011-06-22 EP disclosed
WO-2010027236-A2 FUSED HETEROCYCLIC COMPOUND LG LIFE SCIENCES LTD. (KR) 2010-03-11 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-20110166121-A1 FUSED HETEROCYCLIC COMPOUND F2, PF4, F11 ALDH1A1 279/4885LMNA 3709/4885MAPT 4280/4885

“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.