SCHEMBL3617880

SCHEMBL3617880

CC(C)(C)N(C(=O)O)C1C2CN(Cc3ccccc3)CC21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 3/20 0.47
S1PR1 P21453 1/20 0.47
FUCA1 P04066 2/20 0.45
ACHE P22303 3/20 0.42
OPRM1 P35372 1/20 0.42
BCHE P06276 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GRIN2B Q13224 1/20 0.41

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
SCHEMBL2692741 1.00 S1PR5 (0.47) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL2692744 1.00 S1PR5 (0.47) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL2692748 1.00 S1PR5 (0.47) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL3527474 0.86 GRIN2B (0.45) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL5652849 0.82 BRD4 (0.43) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL66496 0.82 BRD4 (0.43) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL1014405 0.81 FUCA1 (0.53) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL19063783 0.79 GBA1 (0.51) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL19100375 0.79 GBA1 (0.51) S1PR5S1PR1FUCA1ACHEOPRM1
SCHEMBL1317322 0.79 HRH3 (0.44) S1PR5S1PR1FUCA1ACHEOPRM1

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-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-01-21 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 (4 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 S1PR5 881/4885S1PR1 761/4885FUCA1 2256/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 S1PR5 881/4885S1PR1 761/4885FUCA1 2256/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 S1PR5 881/4885S1PR1 761/4885FUCA1 2256/4885
US-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 S1PR5 152/4885S1PR1 181/4885FUCA1 2362/4885

“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.