SCHEMBL15947157

SCHEMBL15947157

CCc1ccc(C)cc1CCN

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 8/20 0.67
HTR2A P28223 2/20 0.49
HTR1D P28221 2/20 0.49
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
BACE1 P56817 2/20 0.44
HTR1A P08908 1/20 0.39
HTR1B P28222 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ADRA1A P35348 1/20 0.36

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
SCHEMBL12959262 0.82 TAAR1 (0.48) TAAR1HTR2AHTR1DCYP1A2CYP2A6
SCHEMBL10822849 0.82 TAAR1 (0.43) TAAR1CYP1A2CYP2A6MAPTRXFP1
SCHEMBL598593 0.81 TAAR1 (0.44) TAAR1CYP1A2CYP2A6MAPTRXFP1
SCHEMBL1869457 0.80 TAAR1 (1.00) TAAR1HTR2AHTR1DCYP1A2CYP2A6
SCHEMBL855681 0.80 TAAR1 (0.69) TAAR1HTR2AHTR1DCYP1A2CYP2A6
SCHEMBL30251350 0.80 TAAR1 (0.69) TAAR1HTR2AHTR1DCYP1A2CYP2A6
SCHEMBL13846533 0.79 HTR2A (0.46) TAAR1HTR2ABACE1
SCHEMBL24809090 0.79 TAAR1 (0.56) TAAR1HTR2AHTR1DBACE1HTR1A
Methane SCHEMBL27570896 0.79 TAAR1 (0.43) TAAR1CYP1A2CYP2A6POLBMAPT
Hydrochloric Acid SCHEMBL18448337 0.78 TAAR1 (0.67) TAAR1HTR2AHTR1DCYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434747-B2 Methods of treating diabetes MEDIVATION TECHNOLOGIES, INC. (US) 2016-09-06 US disclosed
US-20140228353-A1 COMPOUNDS AND METHODS OF TREATING DIABETES MEDIVATION TECHNOLOGIES, INC. (US) 2014-08-14 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-20140228353-A1 COMPOUNDS AND METHODS OF TREATING DIABETES ADRB2, ADRA2B, ADRA2C TAAR1 131/4885HTR2A 5/4885HTR1D 86/4885

“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.