SCHEMBL7250544

SCHEMBL7250544

Cc1ccc2c(c1)[nH]c1cc(OCCN)ccc12

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.49
MAOA P21397 8/20 0.46
DYRK1A Q13627 2/20 0.46
ALK Q9UM73 1/20 0.42
HTR2A P28223 1/20 0.42
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
PARP1 P09874 1/20 0.39

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
SCHEMBL1798750 0.90 MAOA (0.46) KIF11MAOADYRK1AALKHTR1A
SCHEMBL7250477 0.86 HTR2A (0.50) MAOADYRK1AHTR2AHTR1DRXFP1
SCHEMBL20434631 0.86 KIF11 (0.50) KIF11MAOADYRK1AHTR1AHTR1B
SCHEMBL7250798 0.84 KIF11 (0.49) KIF11MAOADYRK1ARXFP1
SCHEMBL1795837 0.84 PARP1 (0.49) KIF11MAOADYRK1AHTR2AHTR1A
SCHEMBL5195511 0.83 MAOA (0.44) MAOADYRK1AALKHTR1AHTR1D
SCHEMBL7108868 0.83 KIF11 (0.54) KIF11MAOA
SCHEMBL20434641 0.82 KIF11 (0.53) KIF11MAOADYRK1A
SCHEMBL1793765 0.82 HTR1A (0.45) KIF11MAOADYRK1AHTR2AHTR1A
SCHEMBL7253761 0.81 PARP1 (0.45) KIF11MAOADYRK1AHTR2AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030040538-A1 Novel substituted tricyclic compounds ASAHI-KASEI KABUSHIKI KAISHA (JP) 2003-02-27 US claimed
EP-1238973-A1 NOVEL SUBSTITUTED TRICYCLIC COMPOUNDS Asahi Kasei Kabushiki Kaisha (JP) 2002-09-11 EP claimed

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-20030040538-A1 Novel substituted tricyclic compounds CPT1A, CBR1, NR1H3 KIF11 4358/4885MAOA 2743/4885DYRK1A 4485/4885

“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.