SCHEMBL25844470

SCHEMBL25844470

COc1cc2c3c(c4c(c2cc1N1CCOCC1)-c1cc(F)cc(F)c1C4(C)C)C=CC(c1ccccc1)(c1ccc(N2CCOCC2)cc1)O3

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 1/20 0.32
EGFR P00533 2/20 0.32
TNIK Q9UKE5 1/20 0.31
MAP4K1 Q92918 1/20 0.31
PIK3CA P42336 1/20 0.30
STK10 O94804 1/20 0.30
SLK Q9H2G2 1/20 0.30
ACVR1 Q04771 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL25844465 0.97 EGFR (0.33) EGFRTNIKKDM4EALDH1A1GAA
SCHEMBL25605384 0.97 HTR1B (0.33) HTR1BEGFRTNIKMAP4K1ACVR1
SCHEMBL25844468 0.96 MAP4K1 (0.33) HTR1BMAP4K1PIK3CASTK10SLK
SCHEMBL25716576 0.95 EGFR (0.31) EGFRTNIK
SCHEMBL25605385 0.94 MEN1 (0.36) HTR1BEGFRTNIKPIK3CAACVR1
SCHEMBL25605386 0.94 HTR1B (0.32) HTR1BEGFRTNIKPIK3CASTK10
SCHEMBL25716577 0.93 HIF1A (0.33) HTR1BMAP4K1PIK3CAACVR1KDM4E
SCHEMBL25844466 0.92 MEN1 (0.32) EGFRTNIKALDH1A1L3MBTL1
SCHEMBL25606028 0.91 EGFR (0.32) EGFRTNIKMAP4K1
SCHEMBL25716578 0.90 MEN1 (0.37) HTR1BMAP4K1PIK3CAACVR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230340318-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES HOYA LENS THAILAND LTD. (TH) 2023-10-26 US disclosed
US-20230340318-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES HOYA LENS THAILAND LTD. (TH) 2023-10-26 US disclosed
US-20230227717-A1 PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-07-20 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-20230340318-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES NR2E3, CRY1, RPS10 HTR1B 1133/4885EGFR 742/4885TNIK 4867/4885

“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.