SCHEMBL29640447

SCHEMBL29640447

CN1CCN(c2ccc3nnc(CCCC(=O)NC4CCN(Cc5ccccc5)CC4)n3n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 7/20 0.56
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
POLB P06746 3/20 0.47
SIGMAR1 Q99720 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
DPP4 P27487 1/20 0.45
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
UBE2N P61088 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL29640209 0.95 RXFP1 (0.56) RXFP1MAOAMAOBPOLBSIGMAR1
SCHEMBL29712074 0.92 RXFP1 (0.53) RXFP1MAOAMAOBPOLBSIGMAR1
SCHEMBL28741971 0.91 SIGMAR1 (0.53) SIGMAR1SMN1; SMN2DPP4
SCHEMBL29640490 0.88 RXFP1 (0.56) RXFP1POLBSIGMAR1KMT2A
SCHEMBL29640473 0.88 RXFP1 (0.53) RXFP1POLBSIGMAR1KMT2A
SCHEMBL29640470 0.88 RXFP1 (0.53) RXFP1MAOAMAOBPOLBSIGMAR1
SCHEMBL29640457 0.87 RXFP1 (0.56) RXFP1MAOAMAOBPOLBSIGMAR1
SCHEMBL29640165 0.86 POLB (0.57) MAOAMAOBPOLBSIGMAR1MEN1
SCHEMBL28741977 0.86 DPP4 (0.49) RXFP1DPP4HSD17B10
SCHEMBL30104693 0.85 RXFP1 (0.55) RXFP1MAOAMAOBSIGMAR1MEN1

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-20220389019-A1 TrkB POSITIVE ALLOSTERIC MODULATORS INSERM - INSTITUT NATIONAL DE LA SANTÉ ET DE LA RECHERCHE MÉDICALE (FR) 2022-12-08 US disclosed
EP-4010341-A1 TRKB POSITIVE ALLOSTERIC MODULATORS Université de Strasbourg (FR) 2022-06-15 EP disclosed
CN-114450006-A TrkB positive allosteric modulators 斯特拉斯堡大学 2022-05-06 CN 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-20220389019-A1 TrkB POSITIVE ALLOSTERIC MODULATORS HTT, NTRK2, BDNF RXFP1 1822/4885MAOA 829/4885MAOB 254/4885

“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.