SCHEMBL16616856

SCHEMBL16616856

N#Cc1n[nH]c2c[c]ccc12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.33
MAP2K1 Q02750 1/20 0.32
MAPK1 P28482 1/20 0.32
ERBB2 P04626 1/20 0.31
NTRK3 Q16288 1/20 0.30

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
SCHEMBL2563702 0.87 NTRK1 (0.34) NTRK1MAP2K1MAPK1ERBB2NTRK3
SCHEMBL1290531 0.76 KDM4E (0.52) MAP2K1ERBB2
SCHEMBL29733448 0.76 KDM4E (0.52) MAP2K1ERBB2
SCHEMBL478628 0.74 PDPK1 (0.54) MAP2K1
SCHEMBL16617333 0.72
SCHEMBL2595676 0.72 MAP2K4 (0.30)
SCHEMBL1230771 0.72 CYP1A2 (0.40)
SCHEMBL11977413 0.70 PDPK1 (0.58) MAPK1ERBB2NTRK3
SCHEMBL31621168 0.70 MAP2K4 (0.44) ERBB2
SCHEMBL16252839 0.70 MAP2K4 (0.51) NTRK1MAPK1ERBB2NTRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180327401-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2018-11-15 US disclosed
US-10077261-B2 Imidazolin-5-one derivative useful as FASN inhibitors for the treatment of cancer JANSSEN PHARMACEUTICA NV (BE) 2018-09-18 US disclosed
US-20160002219-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2016-01-07 US disclosed
US-20150099730-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA, NV (BE) 2015-04-09 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 (4 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-20150099730-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER FASN, PLIN1, FABP1 NTRK1 2382/4885MAP2K1 3683/4885MAPK1 1547/4885
US-10077261-B2 Imidazolin-5-one derivative useful as FASN inhibitors for the treatment of cancer FASN, PLIN1, FABP1 NTRK1 2382/4885MAP2K1 3683/4885MAPK1 1547/4885
US-20180327401-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER FASN, PLIN1, FABP1 NTRK1 2382/4885MAP2K1 3683/4885MAPK1 1547/4885
US-20160002219-A1 IMIDAZOLIN-5-ONE DERIVATIVE USEFUL AS FASN INHIBITORS FOR THE TREATMENT OF CANCER FASN, PLIN1, FABP1 NTRK1 2382/4885MAP2K1 3683/4885MAPK1 1547/4885

“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.