SCHEMBL5558831

SCHEMBL5558831

C[Si](C)(C)c1c(O)cccc1Br

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
CA2 P00918 4/20 0.36
LMNA P02545 3/20 0.36
HPGD P15428 3/20 0.36
ALOX15 P16050 3/20 0.36
HSD17B10 Q99714 3/20 0.36
CA1 P00915 3/20 0.36
EGFR P00533 2/20 0.36
FYN P06241 2/20 0.36
MMP9 P14780 2/20 0.36
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ADAMTS4 O75173 1/20 0.36
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
CA6 P23280 1/20 0.36
CDK2 P24941 1/20 0.36
MMP12 P39900 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
TRPA1 O75762 2/20 0.34

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
SCHEMBL20819712 0.83 ALDH1A1 (0.39) ALDH1A1NPC1RAB9AMAPTMAPK1
SCHEMBL30603262 0.83 ALDH1A1 (0.45) ALDH1A1CA2LMNAHPGDALOX15
SCHEMBL7810681 0.79 TRPA1 (0.34) ALDH1A1CA2LMNAHPGDALOX15
SCHEMBL8414442 0.77 CA1 (0.33) ALDH1A1CA2LMNAHPGDALOX15
SCHEMBL9860862 0.74 ALDH1A1 (0.38) ALDH1A1CA2LMNAHPGDALOX15
SCHEMBL6943096 0.74 IDO1 (0.35) ALDH1A1
SCHEMBL24125843 0.73 HSD11B1 (0.38) ALDH1A1LMNAHPGDNPC1RAB9A
SCHEMBL18796222 0.73 LMNA (0.36) ALDH1A1CA2LMNAHPGDALOX15
SCHEMBL31283290 0.73 MAOB (0.33) ALDH1A1LMNATDP1NPC1RAB9A
SCHEMBL2636253 0.73 MAOB (0.33) ALDH1A1LMNATDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7304155-B2 Tetrahydrobenzfluorene derivatives N.V. ORGANON (NL) 2007-12-04 US disclosed
US-20050119264-A1 Tetrahydrobenzfluorene derivatives MERCK SHARP & DOHME B.V. (NL) 2005-06-02 US disclosed
EP-0601642-B1 Photographic silver halide material and process EASTMAN KODAK CO (US) 1999-09-01 EP disclosed
EP-0601642-A1 Photographic silver halide material and process EASTMAN KODAK COMPANY (US) 1994-06-15 EP disclosed
US-5306604-A Dispersibility, low melting points EASTMAN KODAK COMPANY (US) 1994-04-26 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-20050119264-A1 Tetrahydrobenzfluorene derivatives ESR1, ESR2, GPER1 ALDH1A1 1382/4885CA2 2581/4885LMNA 2534/4885

“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.