SCHEMBL1377271

SCHEMBL1377271

COc1[c]cc(C)c(S(=O)(=O)O)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.33
POLB P06746 1/20 0.33
RECQL P46063 1/20 0.33
ESR2 Q92731 1/20 0.33
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
HIF1A Q16665 1/20 0.32
TP53 P04637 1/20 0.31
CREBBP Q92793 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 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
SCHEMBL9164749 0.82 LMNA (0.36) HIF1AALDH1A1LMNAMAPTKMT2A
SCHEMBL1374507 0.82 ALDH1A1 (0.39) POLBRECQLCDC25ACDC25BHIF1A
SCHEMBL1424151 0.81
SCHEMBL7129933 0.81 ALDH1A1 (0.34) ALDH1A1LMNAKMT2A
SCHEMBL21715145 0.79 LMNA (0.45) POLBALDH1A1LMNAKMT2A
SCHEMBL7046102 0.79 ALDH1A1 (0.39) POLBCDC25ACDC25BHIF1AALDH1A1
SCHEMBL7752958 0.77 BRD4 (0.37) BRD4POLBRECQLESR2TP53
SCHEMBL14674854 0.76
SCHEMBL10508320 0.76 BRD4 (0.36) BRD4POLBRECQLESR2HIF1A
SCHEMBL9626800 0.74 P2RX3 (0.39) BRD4HIF1ATP53CREBBPALDH1A1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050266-B1 REACTIVE DISAZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING MATERIALS THAT CONTAIN HYDROXYL AND/OR NITROGEN BAYER AG (DE) 1984-10-03 EP claimed
EP-4103141-A1 ORAL CARE COMPOSITION AND DEVICES FORMED THEREWITH Ranir, LLC (US) 2022-12-21 EP disclosed
EP-3999023-A1 METHOD TO INCORPORATE OLEANOLIC ACID INTO ORAL CARE COMPOSITIONS AND ORAL CARE COMPOSITIONS BASED THEREOF Colgate-Palmolive Company (US) 2022-05-25 EP disclosed
WO-2021160183-A1 ORAL CARE COMPOSITION AND DEVICES FORMED THEREWITH RANIR, LLC (US) 2021-08-19 WO disclosed
WO-2021035378-A1 METHOD TO INCORPORATE OLEANOLIC ACID INTO ORAL CARE COMPOSITIONS AND ORAL CARE COMPOSITIONS BASED THEREOF COLGATE-PALMOLIVE COMPANY (US) 2021-03-04 WO disclosed
EP-2391683-B1 FIBER-REACTIVE COPPER COMPLEX DISAZO DYES DYSTAR COLOURS DISTRIB GMBH (DE) 2017-03-29 EP disclosed
US-9062208-B2 Fiber-reactive copper complex disazo dyes DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-06-23 US disclosed
US-8834619-B2 Ink composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2014-09-16 US disclosed
EP-2687565-A1 INK COMPOSITION, INKJET PRINTING INK, AND INKJET PRINTING METHOD FUJIFILM Corporation (JP) 2014-01-22 EP disclosed
US-20140013997-A1 INK COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
EP-0719841-A1 Mixture of water soluble reactive azo dyes, process to manufacture it and its use HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-03 EP disclosed
US-5399674-A Dyestuffs containing pyrimidine-carboxylic acid amide radical having fiber-reactive group, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-21 US disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed
EP-0624630-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-17 EP disclosed
EP-0603595-A1 Fibre reactive dyes, method for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-29 EP disclosed
US-5280110-A Fiber-reactive dye HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
EP-0548792-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0385426-A1 Water soluble reactive dyes, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-05 EP disclosed
EP-0354409-A1 Fibre-reactive dyes, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-02-14 EP disclosed
EP-0050266-B1 REACTIVE DISAZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING MATERIALS THAT CONTAIN HYDROXYL AND/OR NITROGEN BAYER AG (DE) 1984-10-03 EP disclosed