SCHEMBL25239794

SCHEMBL25239794

O=C(c1ccccc1)N1CCN(CCC2CCCCC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.64
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
KCNH2 Q12809 1/20 0.59
KDM4E B2RXH2 3/20 0.57
ALDH1A1 P00352 3/20 0.57
POLB P06746 1/20 0.57
SIGMAR1 Q99720 1/20 0.56
KCNA5 P22460 1/20 0.56
DRD2 P14416 1/20 0.56
HTR2A P28223 1/20 0.56
HPGD P15428 1/20 0.55
NAMPT P43490 1/20 0.54
USP2 O75604 1/20 0.54
SLC18A3 Q16572 1/20 0.53

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
SCHEMBL8691723 0.89 HPGD (0.59) CHRM3KMT2AMEN1KCNH2ALDH1A1
SCHEMBL25732839 0.83 DRD3 (0.64) POLBKCNA5DRD2HPGD
SCHEMBL25238971 0.81 HPGD (0.64) KMT2AKDM4EALDH1A1KCNA5DRD2
SCHEMBL14366509 0.81 KMT2A (0.71) KMT2AMEN1KCNH2KDM4EALDH1A1
SCHEMBL7634958 0.81 KMT2A (0.71) KMT2AMEN1KCNH2KDM4EALDH1A1
SCHEMBL7824996 0.80 HTT (0.61)
SCHEMBL27577326 0.79 CHRM3 (0.57) CHRM3KMT2AMEN1ALDH1A1SIGMAR1
SCHEMBL18770805 0.79 DRD2 (0.82) KMT2AMEN1KCNH2KDM4EALDH1A1
SCHEMBL18199757 0.78 CHRM3 (1.00) CHRM3KMT2AMEN1DRD2
SCHEMBL31178357 0.78 KMT2A (0.62) KMT2AMEN1KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066320-A1 Active Ingredients with Sialagogue and Tingling/Fizzy Effect, and Preparations Containing Same SYMRISE AG (DE) 2025-02-27 US claimed
US-20250066320-A1 Active Ingredients with Sialagogue and Tingling/Fizzy Effect, and Preparations Containing Same SYMRISE AG (DE) 2025-02-27 US disclosed
EP-4452941-A1 ACTIVE INGREDIENTS WITH SIALAGOGUE AND TINGLING/FIZZY EFFECT, AND PREPARATIONS CONTAINING SAME Symrise AG (DE) 2024-10-30 EP disclosed
WO-2023117119-A1 ACTIVE INGREDIENTS WITH SIALAGOGUE AND TINGLING/FIZZY EFFECT, AND PREPARATIONS CONTAINING SAME SYMRISE AG (DE) 2023-06-29 WO disclosed
WO-2023117119-A1 ACTIVE INGREDIENTS WITH SIALAGOGUE AND TINGLING/FIZZY EFFECT, AND PREPARATIONS CONTAINING SAME SYMRISE AG (DE) 2023-06-29 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-20250066320-A1 Active Ingredients with Sialagogue and Tingling/Fizzy Effect, and Preparations Containing Same TAS2R5, TAS2R7, TAS2R8 CHRM3 1879/4885KMT2A 2748/4885MEN1 714/4885

“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.