SCHEMBL3478846

SCHEMBL3478846

CCc1ncc(OC)c2ccc(Cl)cc12

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 15/20 0.47
PDE4D Q08499 1/20 0.43
S1PR4 O95977 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
IDO1 P14902 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
SCHEMBL883238 0.80 PDE5A (0.43) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL22114191 0.79 GABRA1 (0.37) PDE10AS1PR4
SCHEMBL8184699 0.79 KMT2A (0.42) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL27919960 0.78 TRPV4 (0.40) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL29122012 0.78 PDE5A (0.41) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL7995744 0.78 ABCB11 (0.40) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL22114190 0.76 GABRA1 (0.42) PDE10APDE4DS1PR4SLC6A2SLC6A4
SCHEMBL3430430 0.75 L3MBTL1 (0.39) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL8273112 0.73 ROCK2 (0.39) ALDH1A1MAPTHPGDHTTTDP1
SCHEMBL3431729 0.73 TRPM8 (0.40) PDE10AALDH1A1MAPTHPGDHTT

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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-19 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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION VIP, EIF2AK2, PREP PDE10A 2832/4885PDE4D 2392/4885S1PR4 3090/4885

“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.