SCHEMBL8066349

SCHEMBL8066349

COc1ccc2c(c1Cl)[C@@H]1CNC[C@@H]1OC2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 14/20 0.40
HTR2B P41595 8/20 0.40
HTR2A P28223 6/20 0.40
SLC6A4 P31645 2/20 0.32
HTR6 P50406 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 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
Hydrochloric Acid SCHEMBL3019962 0.99 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4HTR6
Hydrochloric Acid SCHEMBL3019965 0.99 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4HTR6
Hydrochloric Acid SCHEMBL3019959 0.99 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4HTR6
SCHEMBL8071399 0.81 HTR2C (0.43) HTR2CHTR2BHTR2ASLC6A4
Hydrochloric Acid SCHEMBL3029337 0.80 HTR2C (0.42) HTR2CHTR2BHTR2ASLC6A4
Hydrochloric Acid SCHEMBL3029341 0.80 HTR2C (0.42) HTR2CHTR2BHTR2ASLC6A4
Hydrochloric Acid SCHEMBL3029339 0.80 HTR2C (0.42) HTR2CHTR2BHTR2ASLC6A4
SCHEMBL8066421 0.78 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4ALDH1A1
Hydrochloric Acid SCHEMBL3019629 0.77 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4ALDH1A1
Hydrochloric Acid SCHEMBL3019626 0.77 HTR2C (0.40) HTR2CHTR2BHTR2ASLC6A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON 2010-08-19 US disclosed
US-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON 2010-08-19 US disclosed
WO-2009037220-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON (NL) 2009-03-26 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 (1 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-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES TPH1, HTR2C, TPH2 HTR2C 2/4885HTR2B 15/4885HTR2A 10/4885

“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.