SCHEMBL3301802

SCHEMBL3301802

CC(=O)Nc1ccc(S(=O)(=O)O)c2cc(S(=O)(=O)O)ccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.66
▸ KMT2A Q03164 4/20 0.47
▸ CA2 P00918 6/20 0.46
▸ CA1 P00915 5/20 0.46
▸ CA9 Q16790 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TIMP3 P35625 3/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CA3 P07451 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ POLB P06746 1/20 0.40

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
SCHEMBL8592778 0.84 CASP6 (0.60) CASP6KMT2ACA2CA1CA9
SCHEMBL8592935 0.83 CASP6 (0.61) CASP6KMT2ACA2CA1CA9
SCHEMBL10897127 0.82 TIMP3 (0.51) CASP6KMT2AALDH1A1MAPTTIMP3
SCHEMBL942276 0.82 CASP6 (0.51) CASP6KMT2ACA2CA1CA9
SCHEMBL27435997 0.81 ALDH1A1 (0.42) CASP6KMT2AALDH1A1HPGDTIMP3
SCHEMBL1857055 0.81 KMT2A (0.59) CASP6KMT2AALDH1A1KDM4EMAPT
SCHEMBL345331 0.81 CASP6 (0.57) CASP6KMT2ACA2CA1CA9
SCHEMBL10960119 0.81 CASP6 (0.60) CASP6KMT2ACA2CA1CA9
SCHEMBL10650573 0.80 ALDH1A1 (0.45) CASP6KMT2ACA2CA1CA9
SCHEMBL4115318 0.80 KMT2A (0.57) CASP6KMT2AALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8758501-B2 Nanoparticulate UV protectant with silicon dioxide coating MERCK PATENT GMBH (DE) 2014-06-24 — — US disclosed
US-20100278882-A1 USE OF PROTEIN MICROBEADS IN COSMETICS BASF SE (DE) 2010-11-04 — — US disclosed
US-7820150-B2 Cosmetic or dermatological formulations of improved pearlescence BEIERSDORF AG (DE) 2010-10-26 — — US disclosed
US-20100093984-A1 EXTRACTION METHOD WIRTH CORINNA 2010-04-15 — — US disclosed
US-20100015070-A1 USE OF NATURAL, RECOMBINANT AND SYNTHETIC RESILINS IN COSMETICS BASF SE (DE) 2010-01-21 — — US disclosed
US-20090220441-A1 Nanoparticulate UV Protectant With Silicon Dioxide Coating PFLUECKER FRANK 2009-09-03 — — US disclosed
US-20090098076-A1 Method For the Production of a Keratin-Binding Effector Molecule BASF SE (DE) 2009-04-16 — — US disclosed
US-20090035238-A1 UV FILTER CAPSULE CONTAINING AN AMINO-SUBSTITUTED HYDROXYBENZOPHENONE MERCK PATENT GMBH (DE) 2009-02-05 — — US disclosed
US-20080261844-A1 Multicolor Cosmetics BEIERSDORF AG (DE) 2008-10-23 — — US disclosed
US-20080193569-A1 Extraction Method for Producing Plant Extracts, Especially Waltheria Paniculata Extracts Containing Tiliroside MERCK PATENT GESELLSCHAFT (DE) 2008-08-14 — — US disclosed
US-7264670-B2 Coloured microstructured effect pigments MERCK PATENT GESELLSCHAFT (DE) 2007-09-04 — — US disclosed
US-20060194057-A1 Silicon dioxide-coated nanoparticulate uv protectant MERCK PATENT GMBH (DE) 2006-08-31 — — US disclosed
US-20060039937-A1 Composition having antioxidant properties MERCK PATENT GMBH (DE) 2006-02-23 — — US disclosed
US-20060002875-A1 Diffractive colorants for cosmetics MERCK PATENT GMBH (DE) 2006-01-05 — — US disclosed
US-20050120917-A1 Coloured microstructured effect pigments MERCK PATENT GMBH (DE) 2005-06-09 — — 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 (8 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-20090220441-A1 Nanoparticulate UV Protectant With Silicon Dioxide Coating CUTA, SUCLG1, TYR CASP6 1074/4885KMT2A 3479/4885CA2 2060/4885
US-20060039937-A1 Composition having antioxidant properties GPX4, GPX1, CAT CASP6 559/4885KMT2A 3220/4885CA2 1013/4885
US-20060002875-A1 Diffractive colorants for cosmetics RARA, RARG, DSG1 CASP6 4663/4885KMT2A 1835/4885CA2 3785/4885
US-20090035238-A1 UV FILTER CAPSULE CONTAINING AN AMINO-SUBSTITUTED HYDROXYBENZOPHENONE TYR, MITF, UROD CASP6 2194/4885KMT2A 1604/4885CA2 4665/4885
US-20080193569-A1 Extraction Method for Producing Plant Extracts, Especially Waltheria Paniculata Extracts Containing Tiliroside MITF, FZD7, LSS CASP6 3533/4885KMT2A 2475/4885CA2 3459/4885
US-20100093984-A1 EXTRACTION METHOD LSS, TREH, STS CASP6 1428/4885KMT2A 3123/4885CA2 3220/4885
US-20080261844-A1 Multicolor Cosmetics CUTA, TYR, LBR CASP6 4630/4885KMT2A 2242/4885CA2 1485/4885
US-20090098076-A1 Method For the Production of a Keratin-Binding Effector Molecule KRT18, KRTCAP2, CUTA CASP6 1371/4885KMT2A 2264/4885CA2 2206/4885

“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.

Send feedback