SCHEMBL10001950

SCHEMBL10001950

C=C(C)C(=O)OCc1cc(C)cc(/N=N/c2ccc(CO)cc2)c1O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.36
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ FTO Q9C0B1 1/20 0.31
▸ STAT3 P40763 1/20 0.31
▸ STAT1 P42224 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ NOS3 P29474 1/20 0.31
▸ NOS1 P29475 1/20 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
SCHEMBL12107154 0.91 THRB (0.41) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL2589702 0.91 THRB (0.41) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL10001949 0.88 L3MBTL1 (0.33) THRBL3MBTL1MAPTSMN1; SMN2
SCHEMBL10001953 0.88 NSD2 (0.31) L3MBTL1NOS3NOS1
SCHEMBL825302 0.87 MAPT (0.49) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL825301 0.87 MAPT (0.49) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL29883561 0.87 MAPT (0.49) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL10001947 0.86 THRB (0.31) THRB
SCHEMBL2589705 0.83 KMT2A (0.37) THRBNPC1RAB9AL3MBTL1MAPT
SCHEMBL1005301 0.81 ACHE (0.36) NPC1RAB9AL3MBTL1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8262948-B2 Intraocular lenses with combinations of UV absorbers and blue light chromophores NOVARTIS AG (CH) 2012-09-11 — — US disclosed
US-8262948-B2 Intraocular lenses with combinations of UV absorbers and blue light chromophores NOVARTIS AG (CH) 2012-09-11 — — US disclosed
US-8207244-B2 Visible light absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-06-26 — — US disclosed
US-8207244-B2 Visible light absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2012-06-26 — — US disclosed
US-20110266505-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES ALCON INC. (CH) 2011-11-03 — — US disclosed
US-20110266505-A1 INTRAOCULAR LENSES WITH COMBINATIONS OF UV ABSORBERS AND BLUE LIGHT CHROMOPHORES ALCON INC. (CH) 2011-11-03 — — US disclosed
US-20110003910-A1 VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS ALCON, INC. (CH) 2011-01-06 — — US disclosed
US-20110003910-A1 VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS ALCON, INC. (CH) 2011-01-06 — — 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-20110003910-A1 VISIBLE LIGHT ABSORBERS FOR OPHTHALMIC LENS MATERIALS CRY1, CRY2, CRYAA THRB 3794/4885NPC1 2053/4885RAB9A 4104/4885

“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.

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