SCHEMBL26242547

SCHEMBL26242547

Cc1ccc2[nH]cc(CCCCN3CCN(c4ccc5oc(C(N)=O)cc5c4)CC3)c2c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.82
ADRA2A P08913 4/20 0.78
ADRA2C P18825 4/20 0.78
ADRA1D P25100 4/20 0.78
ADRA1A P35348 4/20 0.78
ADRA1B P35368 4/20 0.78
ADRA2B P18089 3/20 0.78
DRD2 P14416 2/20 0.78
SLC6A2 P23975 2/20 0.78
SLC6A4 P31645 2/20 0.78
HTR7 P34969 2/20 0.78
SLC6A3 Q01959 2/20 0.78
KCNH2 Q12809 1/20 0.78
ADRB2 P07550 1/20 0.77
DRD4 P21917 1/20 0.77
FPR3 P25089 1/20 0.77
HTR1D P28221 1/20 0.77
HTR1B P28222 1/20 0.77
GPR183 P32249 1/20 0.77
HRH1 P35367 1/20 0.77

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
SCHEMBL13534461 0.91 HTR1A (0.83) HTR1AADRA2AADRA2CADRA1DADRA1A
SCHEMBL16965324 0.91 HTR1A (0.83) HTR1AADRA2AADRA2CADRA1DADRA1A
SCHEMBL3737391 0.90 HTR1A (1.00) HTR1AADRA2AADRA2CADRA1DADRA1A
SCHEMBL13532804 0.90 HTR1A (0.82) HTR1AADRA2AADRA2CADRA1DADRA1A
SCHEMBL15782597 0.89 HTR1A (0.81) HTR1AADRA2AADRA2CADRA1DADRA1A
Vilazodone SCHEMBL4423647 0.88 HTR1A (1.00) HTR1AADRA2AADRA2CADRA1DADRA1A
Vilazodone SCHEMBL29357448 0.88 HTR1A (1.00) HTR1AADRA2AADRA2CADRA1DADRA1A
Vilazodone SCHEMBL650682 0.88 HTR1A (1.00) HTR1AADRA2AADRA2CADRA1DADRA1A
Vilazodone SCHEMBL30051446 0.88 HTR1A (1.00) HTR1AADRA2AADRA2CADRA1DADRA1A
SCHEMBL30931545 0.88 HTR1A (0.81) HTR1AADRA2AADRA2CADRA1DADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4268802-A1 VILAZODONE PHARMACEUTICAL COMPOSITION, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Yonsun Biotechnology Co., Ltd. (CN) 2023-11-01 EP disclosed
US-20230285405-A1 Pharmaceuticals for Treating or Preventing Nidoviruses and Picornaviruses THE UNIVERSITY OF CHICAGO (US) 2023-09-14 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 (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-20230285405-A1 Pharmaceuticals for Treating or Preventing Nidoviruses and Picornaviruses CTRB1, CMA1, MAN2B1 HTR1A 198/4885ADRA2A 94/4885ADRA2C 241/4885

“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.