SCHEMBL3322980

SCHEMBL3322980

NC(=O)CN1CCN(Cc2ccccc2F)CC1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
KDM4E B2RXH2 4/20 0.63
LMNA P02545 2/20 0.63
HTT P42858 2/20 0.63
KMT2A Q03164 6/20 0.59
MEN1 O00255 5/20 0.59
POLB P06746 2/20 0.58
ATM Q13315 2/20 0.57
MAPK1 P28482 1/20 0.57
CYP2A13 Q16696 1/20 0.55
DRD4 P21917 1/20 0.54
ALDH3A1 P30838 1/20 0.51
SIGMAR1 Q99720 1/20 0.50
GPR183 P32249 1/20 0.50

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
SCHEMBL21044044 0.86 KMT2A (0.62) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL16226380 0.83 ALDH1A1 (0.81) ALDH1A1KDM4ELMNAHTTKMT2A
Hydrochloric Acid SCHEMBL9052930 0.82 ALDH1A1 (0.60) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL27597072 0.78 ALDH1A1 (0.64) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL8261374 0.78 ALDH1A1 (0.70) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL27615799 0.78 MEN1 (0.64) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL3322986 0.77 ALDH1A1 (0.66) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL3158860 0.77 ALDH1A1 (0.68) ALDH1A1KDM4ELMNAKMT2AATM
SCHEMBL20765529 0.76 ALDH1A1 (0.74) ALDH1A1KDM4ELMNAHTTKMT2A
SCHEMBL3262128 0.76 ALDH1A1 (0.96) ALDH1A1KDM4ELMNAHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases NOVARTIS AG (CH) 2010-05-20 US disclosed
EP-2142535-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES Novartis Ag (CH) 2010-01-13 EP disclosed
WO-2008119741-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2008-10-09 WO 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-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases MDM4, TP53, MDM2 ALDH1A1 2589/4885KDM4E 920/4885LMNA 2574/4885

“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.