SCHEMBL19852142

SCHEMBL19852142

Fc1ccc(OC2COCCN(CC3Cc4cccnc4C3)C2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.35
DRD4 P21917 1/20 0.35
OPRL1 P41146 3/20 0.35
HTR2A P28223 3/20 0.33
MLNR O43193 1/20 0.33
HTR7 P34969 1/20 0.33
HTR1A P08908 1/20 0.33
DRD1 P21728 1/20 0.33
DRD3 P35462 1/20 0.33
AVPR1A P37288 1/20 0.33
PDE9A O76083 1/20 0.33
NAMPT P43490 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
NFE2L2 Q16236 2/20 0.32
MAPK14 Q16539 1/20 0.32
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
HPGD P15428 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL19838591 0.83 HTR7 (0.44) DRD2OPRL1HTR2AMLNRHTR7
Hydrochloric Acid SCHEMBL19839881 0.82 HTR7 (0.43) DRD2OPRL1HTR2AMLNRHTR7
SCHEMBL19852421 0.79 HTR2A (0.43) DRD2OPRL1HTR2AMLNRHTR7
SCHEMBL19852486 0.79 OGA (0.30) MLNR
SCHEMBL19852422 0.73 HTR2A (0.41) DRD2DRD4HTR2AHTR7HTR1A
SCHEMBL19852127 0.70 GAA (0.36) DRD2HTR2AHTR7DRD3PDE9A
SCHEMBL19852012 0.70 HRH3 (0.54) HTR7KCNH2
SCHEMBL19852011 0.68 HTR7 (0.54) DRD2HTR2AHTR7HTR1AHTR2C
SCHEMBL19852013 0.68 SIGMAR1 (0.42) DRD2OPRL1HTR2AHTR7HTR1A
SCHEMBL21071464 0.67 HTR7 (0.44) OPRL1HTR2AMLNRHTR7KCNH2

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 69/4885DRD4 237/4885OPRL1 60/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C DRD2 69/4885DRD4 237/4885OPRL1 60/4885

“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.