SCHEMBL14985698

SCHEMBL14985698

CC(C)N1Cc2ccccc2[C@H]1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.45
MAPT P10636 2/20 0.41
RGS12 O14924 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR2A P28223 2/20 0.40
PRCP P42785 2/20 0.40
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
SLC6A3 Q01959 3/20 0.40
OPRM1 P35372 3/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38

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
SCHEMBL12921565 1.00 DRD4 (0.45) DRD4MAPTRGS12KDM4EMEN1
SCHEMBL18965094 0.81 HTR2A (0.38) DRD4HTR2APRCPSLC6A2SLC6A4
SCHEMBL21236187 0.81 PRCP (0.45) HTR2APRCPHTR2CHTR2BACE
SCHEMBL2706549 0.81 PRCP (0.40) DRD4HTR2APRCPSLC6A2SLC6A4
SCHEMBL4737669 0.81 PRCP (0.40) DRD4HTR2APRCPSLC6A2SLC6A4
SCHEMBL12226743 0.81 PRCP (0.45) HTR2APRCPHTR2CHTR2BACE
SCHEMBL18462680 0.78 ACE (0.37) MEN1KMT2AHTR2APRCPSLC6A2
SCHEMBL18364111 0.78 HTR2A (0.36) DRD4HTR2APRCPSLC6A2SLC6A4
SCHEMBL19440248 0.78 ACE (0.37) MEN1KMT2AHTR2APRCPSLC6A2
SCHEMBL8206740 0.78 PRCP (0.50) HTR2APRCPSLC6A2SLC6A4SLC6A3

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-20130137877-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-05-30 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-20130137877-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 DRD4 1743/4885MAPT 2923/4885RGS12 3829/4885

“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.