SCHEMBL2348902

SCHEMBL2348902

COC(=O)COC(=O)c1ccc(N)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
CYP1A2 P05177 3/20 0.62
CYP3A4 P08684 3/20 0.62
MAOA P21397 2/20 0.62
TSHR P16473 3/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
PDE4D Q08499 1/20 0.56
PHLPP2 Q6ZVD8 1/20 0.54
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MAPT P10636 2/20 0.53
SCN1A P35498 2/20 0.53
SCN2A Q99250 2/20 0.53
SCN3A Q9NY46 2/20 0.53
CYP2D6 P10635 2/20 0.51
HTR3A P46098 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51
ADRB2 P07550 2/20 0.51

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
SCHEMBL12035659 0.91 TSHR (0.55) TSHRALDH1A1NPC1RAB9AMAPT
SCHEMBL11375136 0.84 LMNA (0.77) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL10301412 0.84 LMNA (0.59) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL13113118 0.81 LMNA (0.67) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL6311599 0.81 TSHR (0.61) LMNACYP1A2TSHRCYP2C9CYP2C19
SCHEMBL10301414 0.81 NPC1 (0.64) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL10301408 0.81 LMNA (0.63) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL16270508 0.81 CYP1A2 (0.56) LMNACYP1A2CYP3A4MAOATSHR
SCHEMBL4268692 0.81 MAPT (0.56) LMNACYP3A4TSHRCYP2C9CYP2C19
SCHEMBL3438972 0.80 LMNA (0.60) LMNACYP1A2CYP3A4MAOATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2011-12-22 US disclosed
US-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2011-12-22 US disclosed
US-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2011-12-22 US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 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-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM AHR, OGFR, OPRM1 LMNA 3132/4885CYP1A2 41/4885CYP3A4 142/4885

“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.