SCHEMBL7251869

SCHEMBL7251869

BrCCOc1ccc2c(c1)[nH]c1cc(-c3ccccc3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.45
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
TNKS2 Q9H2K2 1/20 0.42
DYRK1A Q13627 1/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
FEN1 P39748 1/20 0.40
MCL1 Q07820 2/20 0.39
KIF11 P52732 2/20 0.39
RHEB Q15382 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
SCHEMBL7517830 0.85 KIF11 (0.54) MAOANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7251072 0.84 RHEB (0.47) MAOANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7251074 0.81 CTSV (0.64) MAOASMN1; SMN2CTSVCTSLDYRK1A
SCHEMBL7250601 0.79 PPARG (0.56) MAOA
SCHEMBL7251253 0.79 DYRK1A (0.49) MAOAMAPTSMN1; SMN2DYRK1A
SCHEMBL7250798 0.78 KIF11 (0.49) MAOANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL1547955 0.78 LSS (0.56) NPC1RAB9A
SCHEMBL533285 0.78 TNKS2 (0.61) NPC1MAPTTNKS2CDK4CCND1
SCHEMBL29533133 0.78 TNKS2 (0.61) NPC1MAPTTNKS2CDK4CCND1
SCHEMBL35210255 0.76 LTA4H (0.57) MAOANPC1MAPTRAB9ASMN1; SMN2

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 MAOA 2743/4885NPC1 65/4885MAPT 4835/4885

“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.