SCHEMBL27174180

SCHEMBL27174180

CCOn1cc(CCN)c2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.59
SCN9A Q15858 1/20 0.48
HTR6 P50406 16/20 0.47
OPRM1 P35372 2/20 0.40
OPRK1 P41145 2/20 0.40
OPRL1 P41146 2/20 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
SCHEMBL2243379 0.84 HTR2A (0.63) HTR2ASCN9AHTR6OPRM1OPRK1
SCHEMBL15319614 0.83 HTR2A (0.51) HTR2ASCN9AHTR6
Hydrochloric Acid SCHEMBL28126599 0.83 HTR2A (0.61) HTR2ASCN9AHTR6OPRM1OPRK1
Hydrochloric Acid SCHEMBL21523197 0.82 HTR2A (0.50) HTR2ASCN9AHTR6
SCHEMBL8161027 0.82 GPR84 (0.41) HTR2AOPRM1OPRL1
SCHEMBL19064619 0.82 HTR2A (0.53) HTR2ASCN9AHTR6
SCHEMBL25295551 0.82 HTR6 (0.55) HTR6
SCHEMBL3170619 0.79 ALDH1A1 (0.39) HTR2A
SCHEMBL21333617 0.78 HTR2A (0.55) HTR2ASCN9AHTR6
SCHEMBL25345505 0.78 HTR2A (0.55) HTR2ASCN9AHTR6

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-20240092780-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-21 US disclosed
WO-2024050395-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-07 WO disclosed
CN-105120876-A Treatment of cancer BENT REBECCA LAMBERT 2015-12-02 CN 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-20240092780-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD DRD2, HNMT, DRD1 HTR2A 73/4885SCN9A 1626/4885HTR6 129/4885

“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.