SCHEMBL19827770

SCHEMBL19827770

NC1COCc2ccc(Cl)c(Cl)c21

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.35
HTR2A P28223 5/20 0.35
HTR2B P41595 4/20 0.35
HTR1A P08908 1/20 0.32
HTR1D P28221 1/20 0.32
HTR7 P34969 1/20 0.32
HRH1 P35367 1/20 0.32
HTR5A P47898 1/20 0.32
PNMT P11086 2/20 0.30

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
SCHEMBL19829939 1.00 HTR2C (0.35) HTR2CHTR2AHTR2BHTR1AHTR1D
SCHEMBL19829933 1.00 HTR2C (0.35) HTR2CHTR2AHTR2BHTR1AHTR1D
Hydrochloric Acid SCHEMBL19810465 0.98 HTR2C (0.34) HTR2CHTR2AHTR2BHTR1AHTR1D
SCHEMBL19827772 0.83
Hydrochloric Acid SCHEMBL19810470 0.81
SCHEMBL19829932 0.79 AADAT (0.36) HTR2CHTR2AHTR2BHTR1AHTR1D
SCHEMBL19827769 0.79 HTR2C (0.49) HTR2CHTR2AHTR2BHTR1AHTR1D
SCHEMBL19827814 0.79 AADAT (0.36) HTR2CHTR2AHTR2BHTR1AHTR1D
SCHEMBL19829931 0.79 AADAT (0.36) HTR2CHTR2AHTR2BHTR1AHTR1D
Hydrochloric Acid SCHEMBL10602739 0.77 AADAT (0.36) HTR2CHTR2AHTR2BHTR1AHTR1D

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11077090-B2 Compounds and compositions and uses thereof SUNOVION PHARMACEUTICALS INC. (MA) 2021-08-03 US disclosed
WO-2018023070-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF SUNOVION PHARMACEUTICALS, INC. (US) 2018-02-01 WO disclosed
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF PGI DRUG DISCOVERY LLC 2018-02-01 US disclosed
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF PGI DRUG DISCOVERY LLC 2018-02-01 US 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-11077090-B2 Compounds and compositions and uses thereof ACHE, CHAT, MAOB HTR2C 196/4885HTR2A 199/4885HTR2B 146/4885
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF ACHE, CHAT, MAOB HTR2C 196/4885HTR2A 199/4885HTR2B 146/4885

“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.