SCHEMBL10247785

SCHEMBL10247785

CCC1Cc2cccc(Cl)c2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
CYP2D6 P10635 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTR1A P08908 4/20 0.40
HTR7 P34969 4/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
CYP19A1 P11511 2/20 0.37
PNMT P11086 1/20 0.37
AADAT Q8N5Z0 1/20 0.35
NOTUM Q6P988 1/20 0.34

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
SCHEMBL32686717 1.00 ADRA2A (0.41) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL24210488 0.84 CYP2D6 (0.45) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL2576932 0.82 ADRA2A (0.39) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL23856944 0.81 TRPM5 (0.41) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL30047864 0.81 TRPM5 (0.41) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL30046780 0.79 CYP19A1 (0.38) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL9245611 0.79 CYP19A1 (0.38) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL32686723 0.78 CYP19A1 (0.37) HTR1AHTR7CYP19A1
SCHEMBL32686719 0.78 DRD2 (0.48) HTR1AHTR7
SCHEMBL32686718 0.78 CYP19A1 (0.37) HTR1AHTR7CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046283-A1 COMPOUNDS FOR TREATING NEUROPSYCHIATRIC CONDITIONS AFRAXIS INC. (US) 2012-02-23 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 (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-20120046283-A1 COMPOUNDS FOR TREATING NEUROPSYCHIATRIC CONDITIONS PAK2, PAK5, PAK6 ADRA2A 2042/4885ADRA2B 2313/4885ADRA2C 2326/4885

“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.