SCHEMBL3850358

SCHEMBL3850358

CC(=O)Oc1cc(C)nn1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.55
MAPK1 P28482 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
GAA P10253 2/20 0.51
KMT2A Q03164 2/20 0.51
TSHR P16473 2/20 0.50
FCGR1A P12314 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KCNJ6 P48051 1/20 0.50
KCNJ5 P48544 1/20 0.50
KCNJ3 P48549 1/20 0.50
P2RY1 P47900 1/20 0.49
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
ATM Q13315 1/20 0.48
MDM2 Q00987 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
Piperazine SCHEMBL15579214 0.92 NTRK1 (0.48) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL28594276 0.89 NTRK1 (0.56) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL28594274 0.89 NTRK1 (0.56) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL20320311 0.84 NTRK1 (0.56) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL21774133 0.84 MAPT (0.49) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL499894 0.83 NTRK1 (0.51) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL20320310 0.83 KMT2A (0.54) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL314157 0.82 MAPT (0.46) MAPK1CYP2C19GAAKMT2ATSHR
SCHEMBL28580354 0.82 GAA (0.52) NTRK1MAPK1CYP1A2CYP2C19GAA
SCHEMBL21775684 0.82 NTRK1 (0.47) NTRK1MAPK1CYP1A2CYP2C19GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090198060-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-06 US disclosed
EP-2025671-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR Nissan Chemical Industries, Ltd. (JP) 2009-02-18 EP 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-20090198060-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, MPL, IL1RN NTRK1 124/4885MAPK1 426/4885CYP1A2 2323/4885

“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.