SCHEMBL18700448

SCHEMBL18700448

Cc1ccc2c(c1)C(c1ccc3c(c1)C(C)C3)(c1ccc3c(c1)C(C)C3)c1cc(Br)ccc1-2

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.38
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
ADRA2A P08913 1/20 0.32
PNMT P11086 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32

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
SCHEMBL14555180 0.93 HTR2A (0.40) HTR2AHTR2CHTR2BOPRM1OPRD1
SCHEMBL14488442 0.84 HTR2A (0.36) HTR2AHTR2CHTR2BOPRM1OPRD1
SCHEMBL15316154 0.80 BACE1 (0.35) PNMT
SCHEMBL13567251 0.75 ALDH1A1 (0.44) OPRK1
SCHEMBL16656146 0.75 ALDH1A1 (0.42)
SCHEMBL27043600 0.74 MAPT (0.46) ACHEOPRK1
SCHEMBL12109715 0.73 PDK2 (0.41) OPRM1OPRD1OPRK1
SCHEMBL28813511 0.72 ALDH1A1 (0.38) ACHEOPRK1
SCHEMBL15316155 0.71 MAPK1 (0.48) ACHEHTR2AHTR2C
SCHEMBL19153470 0.71 ACHE (0.45) ACHE

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-20170098770-A1 POLYMERS, MONOMERS AND METHODS OF FORMING POLYMERS CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2017-04-06 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-20170098770-A1 POLYMERS, MONOMERS AND METHODS OF FORMING POLYMERS PCNA, PARG, PARN ACHE 3154/4885HTR2A 1255/4885HTR2C 804/4885

“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.