SCHEMBL19852340

SCHEMBL19852340

c1ccc(O[C@@H]2COC3(CCN(C[C@@H]4CCc5ccccc54)CC3)C2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.40
HTR6 P50406 1/20 0.34
HTR1A P08908 4/20 0.34
SIGMAR1 Q99720 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
HSD11B1 P28845 1/20 0.34
DRD2 P14416 3/20 0.33
DRD4 P21917 3/20 0.33
DRD3 P35462 3/20 0.33
HTR2A P28223 1/20 0.33

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
SCHEMBL19852341 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL21071936 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL19852086 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL19852491 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL19852488 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL21071954 1.00 HTR7 (0.40) HTR7HTR6HTR1ASIGMAR1OPRM1
SCHEMBL21071812 0.89 HTR7 (0.37) HTR7HTR6HTR1ASIGMAR1DRD2
SCHEMBL21071728 0.89 HTR7 (0.37) HTR7HTR6HTR1ASIGMAR1DRD2
SCHEMBL19839305 0.89 HTR7 (0.37) HTR7HTR6HTR1ASIGMAR1DRD2
SCHEMBL19852167 0.89 HTR7 (0.37) HTR7HTR6HTR1ASIGMAR1DRD2

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-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SUNOVION PHARMACEUTICALS INC. (US) 2021-11-30 US disclosed
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SUNOVION PHARMACEUTICALS INC. (US) 2021-11-30 US disclosed
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2019-06-27 US disclosed
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2019-06-27 US disclosed
WO-2018026371-A1 DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2018-02-08 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 (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-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SCN2A, HTR2A, HTR2C HTR7 112/4885HTR6 42/4885HTR1A 13/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C HTR7 112/4885HTR6 42/4885HTR1A 13/4885

“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.