SCHEMBL4859489

SCHEMBL4859489

Brc1ccccc1Oc1ccccc1.[MgH2]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.50
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
HRH1 P35367 1/20 0.44
CTNNB1 P35222 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
RIPK1 Q13546 1/20 0.42
HPGD P15428 1/20 0.42
NTRK1 P04629 1/20 0.41
NTRK3 Q16288 1/20 0.41
NTRK2 Q16620 1/20 0.41
KDM1A O60341 2/20 0.41
HTR1A P08908 1/20 0.41

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
SCHEMBL130304 0.98 LTA4H (0.52) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL8954758 0.93 LTA4H (0.55) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL28857814 0.93 TSHR (0.48) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL74839 0.90 ALDH1A1 (0.52) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL3843172 0.88 ALDH1A1 (0.50) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL8954774 0.87 MAOB (0.48) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL3040454 0.85 ALDH1A1 (0.47) LMNAKMT2AALDH1A1HTTMAPK1
SCHEMBL5567756 0.85 NCOA1 (0.47) LTA4HTSHRLMNAGAAKMT2A
SCHEMBL3839158 0.84 ALDH1A1 (0.44) LMNAGAAKMT2AALDH1A1HTT
SCHEMBL3845666 0.84 SLC6A4 (0.53) TSHRLMNAKMT2AALDH1A1HTT

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-7459555-B2 Photochromic naphthopyrans RODENSTOCK GMBH (DE) 2008-12-02 US disclosed
US-20020052499-A1 Photochromic naphthopyrans OPTISCHE WERKE G. RODENSTOCK 2002-05-02 US disclosed
US-6342459-B1 PHOTOCHROMIC COMPOUNDS AND ARTICLES OF RESIN FOR OPTHTHALMIC LENSES OPTISCHE WERKE G. RODENSTOCK (DE) 2002-01-29 US disclosed
US-6331625-B1 EYEGLASS LENSES; RAPID COLOR AND BRIGHTNESS ADJUSTMENT OPTISCHE WERKE G. RODENSTOCK (DE) 2001-12-18 US disclosed
US-6225466-B1 FOR ARTICLES MADE OF SYNTHETIC RESIN MATERIALS; RAPID DARKENING AND BRIGHTENING RATES, DURABILITY OPTISCHE WERKE G. RODENSTOCK (DE) 2001-05-01 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-20020052499-A1 Photochromic naphthopyrans BPNT1, NR2E3, BRIX1 LTA4H 1700/4885TSHR 2981/4885LMNA 649/4885

“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.