SCHEMBL4922183

SCHEMBL4922183

CCOc1ccc(-n2c(Cl)nc3ccc(Cl)cc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 9/20 0.47
KMT2A Q03164 2/20 0.45
EHMT2 Q96KQ7 1/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MCHR1 Q99705 1/20 0.41

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
SCHEMBL4921791 0.90 PDE2A (0.49) CACNA2D1MAPTNPC1
SCHEMBL4927269 0.90 CACNA2D1 (0.48) CACNA2D1MAPT
SCHEMBL4925569 0.89 MCHR1 (0.48) CACNA2D1KMT2AEHMT2MAPTHPGD
SCHEMBL4931085 0.85 CACNA2D1 (0.43) CACNA2D1KMT2AMAPTMEN1NPC1
SCHEMBL4931125 0.85 CYP19A1 (0.48) KMT2AMAPTMEN1NPC1HPGD
SCHEMBL4933013 0.83 PDE2A (0.38) KMT2AMAPTMEN1
SCHEMBL4933479 0.83 CACNA2D1 (0.45) CACNA2D1KMT2AEHMT2MAPTALDH1A1
SCHEMBL4926405 0.80 NPC1 (0.56) CACNA2D1KMT2AMAPTNPC1HPGD
SCHEMBL4930490 0.80 HTT (0.53) CACNA2D1MAPTALDH1A1
Hydrochloric Acid SCHEMBL4925649 0.79 NPC1 (0.55) CACNA2D1KMT2AMAPTNPC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
EP-1810677-A1 RECEPTOR FUNCTION REGULATING AGENT Takeda Pharmaceutical Company Limited (JP) 2007-07-25 EP 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-20080021069-A1 Receptor Function Regulating Agent GPR119, INSR, GPR65 CACNA2D1 3298/4885KMT2A 1963/4885EHMT2 1588/4885

“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.