SCHEMBL19852005

SCHEMBL19852005

COc1cccc(OC2CCN(CC3CCOc4ccccc43)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.50
KCNH2 Q12809 2/20 0.48
CCR3 P51677 2/20 0.41
HRH1 P35367 1/20 0.41
OPRK1 P41145 1/20 0.40
FPR2 P25090 1/20 0.40
PROKR1 Q8TCW9 1/20 0.40
EPHX2 P34913 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37

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
SCHEMBL19852001 0.88 KCNH2 (0.43) HTR1AKCNH2OPRK1CARM1PRMT6
SCHEMBL19852004 0.84 KCNH2 (0.55) HTR1AKCNH2ADRA1DADRA1AADRA1B
SCHEMBL19838628 0.81 HTR2A (0.41) HTR1AKCNH2CCR3HRH1CARM1
Hydrochloric Acid SCHEMBL19838581 0.81 HTR2A (0.41) HTR1AKCNH2CCR3HRH1CARM1
SCHEMBL19852006 0.79 HRH3 (0.56) HTR1AKCNH2CCR3HRH1FPR2
SCHEMBL10408542 0.76 KCNH2 (0.59) HTR1AKCNH2
SCHEMBL19852003 0.74 KCNH2 (0.41) HTR1AKCNH2EPHX2
SCHEMBL19852280 0.74 KCNH2 (0.45) HTR1AKCNH2
SCHEMBL19852460 0.73 KCNH2 (0.46) HTR1AKCNH2ADRA1DADRA1AADRA1B
SCHEMBL19852304 0.73 MTNR1A (0.49) HTR1ACARM1PRMT6

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 HTR1A 13/4885KCNH2 158/4885CCR3 4857/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C HTR1A 13/4885KCNH2 158/4885CCR3 4857/4885

“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.