SCHEMBL4523655

SCHEMBL4523655

CCONCCCc1ccccc1OCCn1c(C)ccc1-c1ccc(C)s1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
PRKCD Q05655 1/20 0.31
PAK1 Q13153 1/20 0.31
CAMK2B Q13554 1/20 0.31
CAMK2G Q13555 1/20 0.31
CAMK2D Q13557 1/20 0.31
TAOK1 Q7L7X3 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL4028898 0.65 PGR (0.44) TBXAS1MAPT
SCHEMBL4026152 0.61 PGR (0.46)
SCHEMBL12377075 0.59 HRH1 (0.60) L3MBTL1MAPTNPSR1
SCHEMBL24712708 0.59 HRH1 (0.55) L3MBTL1ALDH1A1TDP1MAPTNPSR1
SCHEMBL919038 0.58 CYP1A2 (0.58) CSNK1A1CSNK1DPRKCDPAK1CAMK2B
SCHEMBL73826 0.57 CYP1A2 (0.52) CSNK1A1CSNK1DPRKCDPAK1CAMK2B
SCHEMBL8523169 0.57 LTB4R (0.55) CSNK1A1CSNK1DPRKCDPAK1CAMK2B
SCHEMBL9245898 0.56 CHRM2 (0.44)
SCHEMBL12072021 0.56 ALOX5 (0.50) CSNK1A1CSNK1DPRKCDPAK1CAMK2B
SCHEMBL21243277 0.56 CYP1A2 (0.51) CSNK1A1CSNK1DPRKCDPAK1CAMK2B

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-20090275565-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED (IN) 2009-11-05 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-20090275565-A1 Substituted aralkyl derivatives UGT1A7, UGT1A10, UGT2B7 TBXAS1 436/4885CSNK1A1 488/4885CSNK1D 221/4885

“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.