SCHEMBL7247667

SCHEMBL7247667

CC(=O)N1CCN(c2nc3c(-c4ccccc4F)nnn3c3ccccc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 5/20 0.48
NPSR1 Q6W5P4 1/20 0.47
PKM P14618 1/20 0.46
SMO Q99835 1/20 0.46
TP53 P04637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
CRHBP P24387 2/20 0.45
CRHR2 Q13324 2/20 0.45
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.41
NCF1 P14598 1/20 0.40
GBA1 P04062 1/20 0.40

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
SCHEMBL7249246 0.89 RXFP1 (0.50) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7243166 0.89 RXFP1 (0.48) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7249285 0.88 RXFP1 (0.58) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7242713 0.87 RXFP1 (0.46) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7242624 0.84 MAPT (0.65) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7241756 0.83 MAPT (0.51) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7242880 0.83 MAPT (0.48) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7244034 0.82 POLB (0.55) RXFP1POLBMAPTNPSR1PKM
SCHEMBL7241998 0.82 KMT2A (0.53) RXFP1POLBMAPTNPSR1TP53
SCHEMBL7245777 0.82 MAPT (0.52) RXFP1POLBMAPTNPSR1PKM

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-20030045532-A1 Triazolo-pyrimidine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2003-03-06 US claimed
US-20030045532-A1 Triazolo-pyrimidine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2003-03-06 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-20030045532-A1 Triazolo-pyrimidine derivatives as ligands for gaba receptors GABRA3, GABRA2, GABRA4 RXFP1 1388/4885POLB 3552/4885MAPT 1447/4885

“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.