SCHEMBL3048337

SCHEMBL3048337

S=C(Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
MAPK1 P28482 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA9 Q16790 1/20 0.59
TDP1 Q9NUW8 2/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.46
LMNA P02545 2/20 0.44
HCAR2 Q8TDS4 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
AKR1B1 P15121 1/20 0.43
IDO1 P14902 1/20 0.43
PAM P19021 1/20 0.42
AGXT P21549 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
SCHEMBL6178783 0.82 MAOB (0.50) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL10854003 0.81 CA12 (0.57) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL17104782 0.81 CA12 (0.57) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL3251246 0.81 ALDH1A1 (0.44) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL28218969 0.79 CA12 (0.65) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL1722105 0.79 CA12 (0.65) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL27352287 0.78 CA12 (0.53) ALDH1A1MAPK1L3MBTL1CA12CA1
Hydrochloric Acid SCHEMBL11753023 0.77 CA12 (0.63) ALDH1A1MAPK1L3MBTL1CA12CA1
Water SCHEMBL11437078 0.77 CA12 (0.96) ALDH1A1MAPK1L3MBTL1CA12CA1
SCHEMBL24002737 0.76 ALDH1A1 (0.61) ALDH1A1MAPK1L3MBTL1CA12CA1

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-8647878-B2 Highly refractive immersion liquids and their use CARL ZEISS AG (DE) 2014-02-11 US disclosed
US-20100212547-A1 Highly Refractive Immersion Liquids And Their Use CARL ZEISS AG (DE) 2010-08-26 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-20100212547-A1 Highly Refractive Immersion Liquids And Their Use NR4A3, NR2E3, NR4A1 ALDH1A1 3757/4885MAPK1 2044/4885L3MBTL1 2996/4885

“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.