SCHEMBL12424486

SCHEMBL12424486

CC(C)C1CCN(CCS)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 5/20 0.33
GNAO1 P09471 5/20 0.33
GNAI1 P63096 5/20 0.33
CARM1 Q86X55 2/20 0.32
PRMT6 Q96LA8 2/20 0.32
PRMT1 Q99873 1/20 0.32
PRMT8 Q9NR22 1/20 0.32
CPN1 P15169 1/20 0.32
CPB2 Q96IY4 1/20 0.32
DRD2 P14416 2/20 0.32
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL25075207 0.86 GNAI3 (0.38) GNAI3GNAO1GNAI1CARM1PRMT6
SCHEMBL4762635 0.82 DRD2 (0.46) GNAI3GNAO1GNAI1DRD2
SCHEMBL26494066 0.82 GNAO1 (0.44) GNAI3GNAO1GNAI1
SCHEMBL24257195 0.82 OPRM1 (0.30) CPN1CPB2
SCHEMBL16980461 0.79 ALOX15 (0.35) GNAI3GNAO1GNAI1HTR2A
SCHEMBL10052289 0.78 ARG1 (0.38) GNAI3GNAO1GNAI1CARM1PRMT6
SCHEMBL1615678 0.78 GNAO1 (0.50) GNAI3GNAO1GNAI1
SCHEMBL12384241 0.78 GNAI3 (0.33) GNAI3GNAO1GNAI1CARM1PRMT6
SCHEMBL2603219 0.78 SLC18A3 (0.43) GNAI3GNAO1GNAI1CARM1PRMT6
SCHEMBL4371445 0.78 ALOX15 (0.50) GNAI3GNAO1GNAI1CARM1PRMT6

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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 GNAI3 3226/4885GNAO1 2674/4885GNAI1 2658/4885

“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.