SCHEMBL8928436

SCHEMBL8928436

CCc1cc2c(s1)-n1c(C)nnc1CN=C2c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.77
PDE4D Q08499 1/20 0.77
PTAFR P25105 15/20 0.57
GABRA1 P14867 3/20 0.55
GABRA5 P31644 3/20 0.55
GABRA2 P47869 3/20 0.55
GABRB2 P47870 3/20 0.55
BRD4 O60885 1/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
CNR1 P21554 1/20 0.55
GABRA3 P34903 1/20 0.55
CYP3A4 P08684 1/20 0.51
ALOX15 P16050 1/20 0.51

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
SCHEMBL8878960 0.89 OPRK1 (0.74) OPRK1PDE4DPTAFRGABRA1GABRA5
Etizolam SCHEMBL30665015 0.87 OPRK1 (1.00) OPRK1PDE4DPTAFRCYP3A4ALOX15
Etizolam SCHEMBL42920 0.87 OPRK1 (1.00) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928426 0.86 GABRA1 (0.59) OPRK1PDE4DPTAFRGABRA1GABRA5
SCHEMBL8928633 0.86 OPRK1 (0.58) OPRK1PDE4DPTAFRGABRA1GABRA5
SCHEMBL8928407 0.86 OPRK1 (0.79) OPRK1PDE4DPTAFRGABRA1GABRA5
SCHEMBL9663031 0.85 PTAFR (0.62) OPRK1PDE4DPTAFRGABRA1GABRA5
Etizolam SCHEMBL10869413 0.84 OPRK1 (0.90) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8878112 0.82 OPRK1 (0.79) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL9864381 0.81 OPRK1 (0.57) OPRK1PDE4DPTAFRLMNACYP3A4

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
US-20250388538-A1 N,N-DIMETHYLTRYPTAMINE SALTS AND CRYSTALLINE SALT FORMS ATAI THERAPEUTICS INC (US) 2025-12-25 US disclosed
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 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-20250388538-A1 N,N-DIMETHYLTRYPTAMINE SALTS AND CRYSTALLINE SALT FORMS SLC6A4, SLC6A2, SLC18A2 OPRK1 159/4885PDE4D 626/4885PTAFR 3797/4885

“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.