SCHEMBL25844144

SCHEMBL25844144

Cc1ccc2c(c1)C(C)(C)c1c3c(c4ccccc4c1-2)OC(c1ccc(Oc2ccccc2)cc1)(c1ccc(N2CCOCC2)cc1)C=C3

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 2/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
ALK Q9UM73 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NTRK1 P04629 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31

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
SCHEMBL25844138 0.94 MAPT (0.35) ALDH1A1MAPK1MAPTLMNAALK
SCHEMBL25844147 0.94 ALK (0.36) ALDH1A1MAPK1MAPTLMNAALK
SCHEMBL25844140 0.93 AKT1 (0.33) ALDH1A1MAPK1MAPTLMNAALK
SCHEMBL25604438 0.91 BTK (0.33) ALDH1A1MAPK1MAPTKDM4ENTRK1
SCHEMBL25844017 0.90
SCHEMBL25601670 0.90 RAF1 (0.36) ALDH1A1MAPK1MAPTKDM4ESMN1; SMN2
SCHEMBL25844115 0.90 ALK (0.33) ALDH1A1MAPK1MAPTLMNAALK
SCHEMBL25844150 0.90 SLC6A2 (0.35) ALDH1A1MAPTLMNAALKMEN1
SCHEMBL25844127 0.90 MAPT (0.35) ALDH1A1MAPK1MAPTLMNAALK
SCHEMBL25844012 0.90

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-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 ALDH1A1 1091/4885CYP1A2 1016/4885CYP2C9 2066/4885

“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.