SCHEMBL19852433

SCHEMBL19852433

c1ccc(N2CCN(CC3CCc4ccccc43)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.53
DRD2 P14416 3/20 0.49
DRD4 P21917 2/20 0.49
SIGMAR1 Q99720 3/20 0.48
HTR1A P08908 2/20 0.48
ACHE P22303 1/20 0.48
CHRNA7 P36544 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TSHR P16473 1/20 0.47
KCNH2 Q12809 1/20 0.46

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
SCHEMBL6795934 0.83 METAP1 (0.51) SIGMAR1HTR1A
SCHEMBL11666517 0.82 DRD2 (0.50) GRIN2BDRD2DRD4CHRNA7KDM4E
SCHEMBL21072108 0.81 DRD2 (0.55) DRD2DRD4SIGMAR1
SCHEMBL14142970 0.80 HTR6 (0.44) SIGMAR1HTR1A
SCHEMBL11176461 0.80 HTR6 (0.44) SIGMAR1HTR1A
SCHEMBL6960133 0.80 DRD2 (0.58) DRD2DRD4SIGMAR1HTR1AKDM4E
SCHEMBL14143207 0.78 HTR6 (0.42) SIGMAR1HTR1A
SCHEMBL14143213 0.78 SIGMAR1 (0.44) SIGMAR1HTR1AACHE
SCHEMBL19852303 0.77 HTR7 (0.57) DRD2DRD4SIGMAR1HTR1A
SCHEMBL7405539 0.77 ALDH1A1 (0.53) DRD2DRD4HTR1A

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 GRIN2B 22/4885DRD2 69/4885DRD4 237/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C GRIN2B 22/4885DRD2 69/4885DRD4 237/4885

“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.