SCHEMBL19852334

SCHEMBL19852334

O=C1CC2(CCN(CC3CCc4ccccc43)C2)Oc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.57
EPHX1 P07099 2/20 0.57
SIGMAR1 Q99720 1/20 0.53
SCN5A Q14524 1/20 0.51
ADRA1D P25100 2/20 0.47
ADRA1A P35348 2/20 0.47
ADRA1B P35368 2/20 0.47
ATM Q13315 1/20 0.44
HRH3 Q9Y5N1 1/20 0.41
CYP2C9 P11712 1/20 0.41
HSD11B1 P28845 1/20 0.40

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
SCHEMBL19852260 0.94 EPHX2 (0.62) EPHX2EPHX1SIGMAR1SCN5AADRA1D
SCHEMBL19852342 0.92 EPHX2 (0.53) EPHX2EPHX1SIGMAR1SCN5AADRA1D
SCHEMBL19852343 0.84 SIGMAR1 (0.52) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19838594 0.79 SIGMAR1 (0.57) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19852338 0.78 SIGMAR1 (0.46) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19852143 0.73 EPHX2 (0.46) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19852125 0.72 SIGMAR1 (0.46) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19852145 0.72 SIGMAR1 (0.46) EPHX2EPHX1SIGMAR1ADRA1DADRA1A
SCHEMBL19852259 0.71 OPRM1 (0.39) SIGMAR1HSD11B1
SCHEMBL19852361 0.70 DRD2 (0.59) SIGMAR1ADRA1DADRA1AADRA1BHSD11B1

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 EPHX2 2521/4885EPHX1 3696/4885SIGMAR1 612/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C EPHX2 2521/4885EPHX1 3696/4885SIGMAR1 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.