SCHEMBL23698337

SCHEMBL23698337

C[C@H](O)CN(CCCN(C)C)CCCN(C)C

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
DNM1 Q05193 3/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
USP2 O75604 1/20 0.31
RECQL P46063 1/20 0.31
CYP1A2 P05177 1/20 0.30
HRH2 P25021 1/20 0.30
HRH4 Q9H3N8 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL15177 1.00 TSHR (0.39) TSHRALDH1A1DNM1HTR2AHRH1
SCHEMBL3826312 0.95 TSHR (0.39) TSHRALDH1A1DNM1HTR2AHRH1
SCHEMBL22739910 0.95 TSHR (0.39) TSHRALDH1A1DNM1HTR2AHRH1
SCHEMBL182026 0.95 TSHR (0.39) TSHRALDH1A1DNM1HTR2AHRH1
SCHEMBL3928045 0.93 TSHR (0.38) TSHRALDH1A1DNM1HTR2AHRH1
SCHEMBL19699299 0.92 MAPT (0.42) TSHRALDH1A1KDM4EMAPT
SCHEMBL22166093 0.92 HTR2A (0.37) TSHRALDH1A1HTR2AHRH1USP2
SCHEMBL16843407 0.92 DNM1 (0.43) TSHRALDH1A1DNM1KDM4ETDP1
SCHEMBL28289558 0.92 ALDH1A1 (0.34) TSHRALDH1A1CYP1A2HRH2HRH4
SCHEMBL23899119 0.92 DNM1 (0.38) TSHRALDH1A1DNM1KDM4ECYP1A2

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-20230210735-A1 PREVENTION, REDUCTION, OR AMELIORATION OF OLD PERSON SMELL FIRMENICH SA (CH) 2023-07-06 US disclosed
EP-4164587-A1 PREVENTION, REDUCTION, OR AMELIORATION OF OLD PERSON SMELL Firmenich SA (CH) 2023-04-19 EP disclosed
WO-2021250130-A1 PREVENTION, REDUCTION, OR AMELIORATION OF OLD PERSON SMELL FIRMENICH SA (CH) 2021-12-16 WO disclosed
EP-3856358-A2 PREVENTION OF THE OXIDATION OF PERFUMERY RAW MATERIALS AND FOOD RAW MATERIALS Firmenich SA (CH) 2021-08-04 EP 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-20230210735-A1 PREVENTION, REDUCTION, OR AMELIORATION OF OLD PERSON SMELL ACHE, RBP4, LPO TSHR 4467/4885ALDH1A1 493/4885DNM1 1512/4885

“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.