SCHEMBL7250798

SCHEMBL7250798

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.49
MAOA P21397 10/20 0.46
DYRK1A Q13627 2/20 0.46
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
ACHE P22303 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
SCHEMBL7251253 0.86 DYRK1A (0.49) MAOADYRK1AMAPTSMN1; SMN2RXFP1
SCHEMBL20434631 0.86 KIF11 (0.50) KIF11MAOADYRK1ANPC1RAB9A
SCHEMBL7250544 0.84 KIF11 (0.49) KIF11MAOADYRK1ARXFP1
SCHEMBL7517830 0.83 KIF11 (0.54) KIF11MAOANPC1MAPTRAB9A
SCHEMBL20434641 0.82 KIF11 (0.53) KIF11MAOADYRK1ANPC1MAPT
SCHEMBL7251769 0.82 MAOA (0.41) KIF11MAOADYRK1ANPC1MAPT
SCHEMBL7250585 0.81 KIF11 (0.53) KIF11MAOADYRK1ANPC1MAPT
SCHEMBL7251072 0.79 RHEB (0.47) KIF11MAOANPC1MAPTRAB9A
SCHEMBL7251220 0.79 PTGS2 (0.48) MAOADYRK1A
SCHEMBL7251869 0.78 MAOA (0.45) KIF11MAOADYRK1ANPC1MAPT

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-20030040538-A1 Novel substituted tricyclic compounds ASAHI-KASEI KABUSHIKI KAISHA (JP) 2003-02-27 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-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.