SCHEMBL4089718

SCHEMBL4089718

O=C(O)c1cc(NCCc2ccc(Cl)cc2Cl)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CNR1 P21554 1/20 0.52
NOX4 Q9NPH5 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
RGS12 O14924 1/20 0.50
ALDH1A1 P00352 1/20 0.50
EGFR P00533 1/20 0.50
LCK P06239 1/20 0.50
MAPT P10636 1/20 0.50
CAMKK2 Q96RR4 1/20 0.50
PPARA Q07869 1/20 0.49
STING1 Q86WV6 1/20 0.49
HPGD P15428 1/20 0.47
KDM4C Q9H3R0 2/20 0.46
GPR84 Q9NQS5 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44
SYK P43405 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL608266 0.86 NOX4 (0.61) CNR1NOX4TDP1RGS12ALDH1A1
SCHEMBL29391103 0.86 NOX4 (0.61) CNR1NOX4TDP1RGS12ALDH1A1
SCHEMBL29388077 0.83 SYK (0.58) CA1CA2CNR1NOX4TDP1
SCHEMBL610123 0.83 SYK (0.58) CA1CA2CNR1NOX4TDP1
SCHEMBL3417018 0.79 MAPT (0.51) CA1CA2NOX4TDP1RGS12
SCHEMBL610065 0.78 KDM4C (0.53) NOX4TDP1RGS12ALDH1A1EGFR
SCHEMBL29391568 0.78 KDM4C (0.53) NOX4TDP1RGS12ALDH1A1EGFR
SCHEMBL28928409 0.77 PPARA (0.52) CA1CA2CNR1NOX4TDP1
SCHEMBL15358317 0.76 IGF1R (0.46) CNR1HPGDGPR84TAAR1MEN1
SCHEMBL607633 0.75 NOX4 (0.61) NOX4TDP1RGS12ALDH1A1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2009-06-11 US claimed
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2007-12-27 US claimed
US-20120301551-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2012-11-29 US disclosed
US-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2009-06-11 US disclosed
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction NEUROTECH PHARMACEUTICALS CO., LTD. (KR) 2007-12-27 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 (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-20090149542-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION BCL2, BAX, SMN1; SMN2 CA1 1856/4885CA2 738/4885CNR1 3748/4885
US-20120301551-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING NEURONAL DEATH OR NEUROLOGICAL DYSFUNCTION BCL2, BAX, SMN1; SMN2 CA1 1856/4885CA2 738/4885CNR1 3748/4885
US-20070298129-A1 Compounds and compositions for treating neuronal death or neurological dysfunction BCL2, BAX, SMN1; SMN2 CA1 1856/4885CA2 738/4885CNR1 3748/4885

“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.