SCHEMBL1102342

SCHEMBL1102342

CCCCCCCCOc1ccc(-c2ccc(Br)s2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.50
CYP2D6 P10635 3/20 0.50
CYP1A2 P05177 2/20 0.50
NR5A1 Q13285 1/20 0.50
RARB P10826 3/20 0.49
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
LTA4H P09960 3/20 0.45
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.44
PLA2G4B P0C869 1/20 0.44
CYP19A1 P11511 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44

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
SCHEMBL16552798 0.89 NR5A1 (0.58) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL13309870 0.89 NR5A1 (0.58) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL3791496 0.87 NR5A1 (0.56) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL2396650 0.87 NR5A1 (0.56) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL16552630 0.87 CYP2D6 (0.58) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL16558130 0.83 NR5A1 (0.51) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL16558135 0.83 NR5A1 (0.51) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL14182498 0.82 CYP3A4 (0.40) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL16558134 0.81 CYP3A4 (0.53) CYP3A4CYP2D6CYP1A2NR5A1RARB
SCHEMBL8984070 0.81 CYP3A4 (0.56) CYP3A4CYP2D6CYP1A2NR5A1RARB

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-8153822-B2 Fluorene compound FUJI XEROX CO., LTD. (JP) 2012-04-10 US disclosed
US-20100197942-A1 NOVEL FLUORENE COMPOUND FUJI XEROX CO., LTD. (JP) 2010-08-05 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-20100197942-A1 NOVEL FLUORENE COMPOUND AFF1, AFF2, FLI1 CYP3A4 1108/4885CYP2D6 1338/4885CYP1A2 78/4885

“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.