SCHEMBL18967271

SCHEMBL18967271

COCCN(C)c1ccc(/C=C/C(=O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.62
MAOA P21397 5/20 0.62
BCHE P06276 1/20 0.55
CYP1B1 Q16678 1/20 0.55
KRAS P01116 2/20 0.53
HSPD1 P10809 1/20 0.51
HSPE1 P61604 1/20 0.51
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
MAPT P10636 1/20 0.47
PTPN1 P18031 1/20 0.47

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
SCHEMBL10046634 0.87 MAOB (0.63) MAOBMAOABCHECYP1B1KRAS
SCHEMBL25194702 0.87 MAOB (0.63) MAOBMAOABCHECYP1B1KRAS
SCHEMBL7196575 0.82 MAOB (0.72) MAOBMAOABCHECYP1B1KRAS
SCHEMBL7194771 0.82 MAOB (0.72) MAOBMAOABCHECYP1B1KRAS
SCHEMBL7194766 0.82 MAOB (0.72) MAOBMAOABCHECYP1B1KRAS
SCHEMBL7196578 0.82 MAOB (0.72) MAOBMAOABCHECYP1B1KRAS
SCHEMBL3033674 0.82 MAPT (0.64) MAPT
SCHEMBL6733854 0.79 MAOB (0.85) MAOBMAOABCHECYP1B1KRAS
SCHEMBL6733848 0.79 MAOB (0.85) MAOBMAOABCHECYP1B1KRAS
SCHEMBL9151812 0.77 MAOB (0.62) MAOBMAOABCHECYP1B1KRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170168073-A1 CHALCONE-UREA DERIVATIVES AS INSULIN SENSORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-06-15 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-20170168073-A1 CHALCONE-UREA DERIVATIVES AS INSULIN SENSORS IAPP, INSR, GPR119 MAOB 3635/4885MAOA 4107/4885BCHE 1056/4885

“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.