SCHEMBL4908979

SCHEMBL4908979

CC(N)(C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)c1ccccc1F

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.64
MEN1 O00255 3/20 0.64
MAOB P27338 1/20 0.49
ATM Q13315 2/20 0.48
NPSR1 Q6W5P4 3/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
HPGD P15428 1/20 0.48
CACNA2D1 P54289 4/20 0.47
CACNB1 Q02641 4/20 0.47
CACNA1B Q00975 3/20 0.47
CACNA1C Q13936 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CACNA1H O95180 1/20 0.47
CACNA1A O00555 1/20 0.47
MGLL Q99685 1/20 0.46

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
SCHEMBL4278102 0.78 KMT2A (0.72) KMT2AMEN1MAOBNPSR1MAPT
SCHEMBL4273008 0.77 KMT2A (0.62) KMT2AMEN1MAOBATMNPSR1
SCHEMBL5140571 0.73 KMT2A (0.72) KMT2AMEN1MAOBNPSR1MAPT
SCHEMBL4752752 0.72 NPSR1 (0.68) KMT2AMEN1MAOBATMNPSR1
SCHEMBL4273981 0.72 KMT2A (0.62) KMT2AMEN1CACNA2D1CACNB1CACNA1B
SCHEMBL13994872 0.71 KMT2A (1.00) KMT2AMEN1MAOBNPSR1MAPT
SCHEMBL5624203 0.71 KMT2A (0.70) KMT2AMEN1MAOBNPSR1MAPT
SCHEMBL15535815 0.70 KCNN4 (0.51) KMT2AMAPT
SCHEMBL714233 0.70 KCNN4 (0.51) KMT2AMAPT
SCHEMBL27545187 0.70 KMT2A (0.74) KMT2AMEN1MAOBNPSR1MAPT

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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 US claimed

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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof HNMT, HDAC5, HDAC4 KMT2A 41/4885MEN1 1807/4885MAOB 106/4885

“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.