SCHEMBL19852011

SCHEMBL19852011

Fc1ccc(OC2CCN(CC3Cc4ccccc4C3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.54
HTR2A P28223 3/20 0.52
SIGMAR1 Q99720 4/20 0.51
DRD2 P14416 2/20 0.48
HTR2C P28335 2/20 0.48
HRH1 P35367 3/20 0.47
CCR3 P51677 3/20 0.47
ADRB2 P07550 1/20 0.45
HTR1A P08908 2/20 0.44
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
OPRK1 P41145 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL19838615 0.87 HTR7 (0.55) HTR7HTR2ASIGMAR1DRD2HTR2C
SCHEMBL19852002 0.86 NAMPT (0.51) HTR7HTR2AHRH1CCR3ADRB2
Hydrochloric Acid SCHEMBL19839766 0.86 HTR7 (0.54) HTR7HTR2ASIGMAR1DRD2HTR2C
SCHEMBL19838591 0.86 HTR7 (0.44) HTR7HTR2ASIGMAR1DRD2HTR2C
Hydrochloric Acid SCHEMBL19839881 0.85 HTR7 (0.43) HTR7HTR2ASIGMAR1DRD2HTR2C
SCHEMBL19852421 0.82 HTR2A (0.43) HTR7HTR2ADRD2HTR2CHRH1
SCHEMBL19852180 0.80 HTR7 (0.51) HTR7HTR2ADRD2HRH1CCR3
SCHEMBL19838952 0.79 NAMPT (0.56) HTR7HTR2AADRB2
SCHEMBL19852349 0.78 SIGMAR1 (0.52) HTR7HTR2ASIGMAR1DRD2HTR2C
SCHEMBL19839851 0.76 HTR7 (0.50) HTR7HTR2AHRH1CCR3ADRB2

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 112/4885HTR2A 2/4885SIGMAR1 612/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C HTR7 112/4885HTR2A 2/4885SIGMAR1 612/4885

“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.