SCHEMBL19852029

SCHEMBL19852029

COc1ccccc1N1CCC2(CCN(CC3CCc4ccccc43)C2)C1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.59
DRD3 P35462 8/20 0.59
HTR2C P28335 3/20 0.47
DRD4 P21917 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
HTR1A P08908 2/20 0.43
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 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
SCHEMBL21072380 0.85 CYP2D6 (0.53)
SCHEMBL19852030 0.85 DRD2 (0.54) DRD2DRD3HTR2CHTR1AADRA1D
SCHEMBL19852301 0.75 HTR7 (0.41) DRD2HTR2CSIGMAR1HTR1A
SCHEMBL19852038 0.74 DRD2 (0.55) DRD2DRD3HTR2CHTR1AADRA1D
SCHEMBL19852300 0.72 HTR7 (0.47) DRD2HTR2CSIGMAR1HTR1A
SCHEMBL6796388 0.72 DRD2 (0.67) DRD2HTR2CDRD4SIGMAR1
SCHEMBL11630742 0.69 HTR2C (0.82) DRD2DRD3HTR2CDRD4SIGMAR1
SCHEMBL11631273 0.69 DRD2 (0.63) DRD2HTR2CDRD4HTR1AADRA1D
SCHEMBL11630860 0.69 DRD2 (0.63) DRD2HTR2CDRD4HTR1AADRA1D
SCHEMBL11630869 0.69 DRD2 (0.63) DRD2HTR2CDRD4HTR1AADRA1D

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 DRD2 69/4885DRD3 290/4885HTR2C 3/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C DRD2 69/4885DRD3 290/4885HTR2C 3/4885

“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.