SCHEMBL19630558

SCHEMBL19630558

COc1ccc(NC(=O)Oc2ccc3nc4ccc(=O)cc-4oc3c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.69
CYP1A2 P05177 1/20 0.56
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.41
POLB P06746 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
SCHEMBL19630614 0.89 APP (0.59) APPCYP1A2ALDH1A1GAAHTT
SCHEMBL31115697 0.83 APP (1.00) APPCYP1A2RAB9ALMNAALDH1A1
SCHEMBL563392 0.83 APP (1.00) APPCYP1A2RAB9ALMNAALDH1A1
SCHEMBL3974521 0.81 APP (0.72) APPCYP1A2ALDH1A1GAAPOLB
SCHEMBL10167882 0.78 APP (1.00) APPCYP1A2RAB9ANPC1
SCHEMBL21211676 0.78 APP (0.70) APPCYP1A2RAB9AALDH1A1GAA
SCHEMBL18932158 0.77 APP (0.74) APPCYP1A2LMNAALDH1A1GAA
SCHEMBL20437651 0.77 APP (0.73) APPCYP1A2RAB9AALDH1A1GAA
SCHEMBL15217855 0.77 APP (0.65) APPCYP1A2RAB9AALDH1A1GAA
SCHEMBL19630632 0.76 APP (0.56) APPCYP1A2

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-20170334865-A1 DDR2 INHIBITORS AND METHODS OF USING WASHINGTON UNIVERSITY (US) 2017-11-23 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-20170334865-A1 DDR2 INHIBITORS AND METHODS OF USING DDR2, DDR1, DDRGK1 APP 3057/4885CYP1A2 4799/4885RAB9A 1994/4885

“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.