SCHEMBL20559554

SCHEMBL20559554

C[C@@H](NC(=O)C1CC1c1nc2ccccc2[nH]1)c1ccc(C(=O)N2CCCCC2)s1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 7/20 0.41
HPGD P15428 1/20 0.38
LPAR2 Q9HBW0 2/20 0.38
TP53 P04637 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL20559817 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20559410 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20558932 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20559411 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20559415 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20559409 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20559820 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20558929 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL20799654 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4
SCHEMBL19146676 1.00 HTR2B (0.41) HTR2BHPGDLPAR2TP53HRH4

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-11420944-B2 Voltage-dependent t-type calcium channel blocker NIPPON CHEMIPHAR CO., LTD. (JP) 2022-08-23 US disclosed
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER NIPPON CHEMIPHAR CO., LTD. (JP) 2019-03-14 US disclosed
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER NIPPON CHEMIPHAR CO., LTD. (JP) 2019-03-14 US disclosed
EP-3404021-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL INHIBITOR Nippon Chemiphar Co., Ltd. (JP) 2018-11-21 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 (2 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-11420944-B2 Voltage-dependent t-type calcium channel blocker CACNA1I, CACNA1G, CACNA1E HTR2B 967/4885HPGD 3512/4885LPAR2 2467/4885
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER CACNA1I, CACNA1G, CACNA1E HTR2B 878/4885HPGD 3843/4885LPAR2 2384/4885

“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.