SCHEMBL14694334

SCHEMBL14694334

C=C(C)C(=O)OCc1cc(C)cc(N=Nc2ccc(Cl)cc2C(=O)c2ccccc2)c1O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.41
▸ S100B P04271 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ THRB P10828 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LMNA P02545 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL14694332 1.00 TP53 (0.41) TP53S100BMAPTTHRBSMN1; SMN2
SCHEMBL14694349 0.83 S100B (0.46) TP53S100BMAPTTHRBSMN1; SMN2
SCHEMBL14694351 0.83 S100B (0.46) TP53S100BMAPTTHRBSMN1; SMN2
SCHEMBL2589705 0.80 KMT2A (0.37) TP53MAPTTHRBSMN1; SMN2ALDH1A1
SCHEMBL2589702 0.77 THRB (0.41) MAPTTHRBSMN1; SMN2ALDH1A1MEN1
SCHEMBL12107154 0.77 THRB (0.41) MAPTTHRBSMN1; SMN2ALDH1A1MEN1
SCHEMBL825301 0.73 MAPT (0.49) MAPTTHRBALDH1A1MEN1POLB
SCHEMBL29883561 0.73 MAPT (0.49) MAPTTHRBALDH1A1MEN1POLB
SCHEMBL10001950 0.73 THRB (0.36) MAPTTHRBSMN1; SMN2MEN1MAPK1
SCHEMBL825302 0.73 MAPT (0.49) MAPTTHRBALDH1A1MEN1POLB

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-8475691-B2 UV-absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2013-07-02 — — US disclosed
WO-2013025671-A1 UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS NOVARTIS AG (CH) 2013-02-21 — — WO disclosed
US-20130043443-A1 UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS NOVARTIS AG (CH) 2013-02-21 — — 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-20130043443-A1 UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS UACA, CRYAA, CRYAB TP53 2101/4885S100B 641/4885MAPT 378/4885

“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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