SCHEMBL7768183

SCHEMBL7768183

N#Cc1cc(Cl)c(F)c(C#N)c1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 4/20 0.36
KHK P50053 1/20 0.36
CYP11B2 P19099 4/20 0.35
AR P10275 5/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 2/20 0.33
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
VCAM1 P19320 1/20 0.32
CYP11B1 P15538 2/20 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
SCHEMBL9693854 0.86 TRPV4 (0.41) TRPV4KHKCYP11B2ALDH1A1MAPK1
SCHEMBL16122585 0.85 ALDH1A1 (0.36) TRPV4KHKCYP11B2ARALDH1A1
SCHEMBL7771115 0.84 TRPV4 (0.42) TRPV4KHK
SCHEMBL8045190 0.83 ALDH1A1 (0.37) TRPV4KHKCYP11B2ARALDH1A1
SCHEMBL8049906 0.83 TRPV4 (0.41) TRPV4KHKCYP11B2ARALDH1A1
SCHEMBL8664249 0.82 TRPV4 (0.39) TRPV4KHKCYP11B2ARALDH1A1
SCHEMBL8727200 0.80 TRPV4 (0.38) TRPV4KHKCYP11B2ARALDH1A1
SCHEMBL7649737 0.77 TRPV4 (0.45) TRPV4KHKCYP11B2ALDH1A1CYP11B1
SCHEMBL5338291 0.77 TRPV4 (0.45) TRPV4KHKCYP11B2ALDH1A1CYP11B1
SCHEMBL7043988 0.77 KHK (0.43) TRPV4KHKCYP11B2ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2169542-A None JP disclosed
EP-0748850-B1 Dyestuffs, process for their preparation and their use CIBA SC HOLDING AG (CH) 2001-07-04 EP disclosed
EP-0735113-B1 Mixtures of reactive dyes and their use CIBA SC HOLDING AG (CH) 2000-10-18 EP disclosed
EP-0735107-B1 Reactive dyes and their use CIBA SC HOLDING AG (CH) 2000-08-30 EP disclosed
EP-0625551-B1 Mixtures of dyes, process for their preparation and the use thereof CIBA GEIGY AG (CH) 1999-09-29 EP disclosed
EP-0631008-B1 Process for the washing of printings or dyeings on cellulose containing textile materials CIBA GEIGY AG (CH) 1999-08-18 EP disclosed
US-5931975-A TRIAZINE REACTIVE DYES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
US-5892006-A CONTAINING S-TRIAZINE RINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-04-06 US disclosed
EP-0625549-B1 Reactive dyes, process for their preparation and the use thereof CIBA GEIGY AG (CH) 1998-07-01 EP disclosed
US-5735911-A TRIAZINE DYES HAVING GOOD WET AND LIGHT FASTNESS PROPERTIES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-04-07 US disclosed
EP-0097289-B1 AZO DYESTUFFS BAYER AG (DE) 1986-10-15 EP disclosed
EP-0190615-A2 Reactive dyes BAYER AG (DE) 1986-08-13 EP disclosed
EP-0177978-A2 Naphthol amine derivatives BAYER AG (DE) 1986-04-16 EP disclosed
EP-0158882-A2 Triphenedioxazine dyes BAYER AG (DE) 1985-10-23 EP disclosed
EP-0128316-A1 Reactive disazo dyes BAYER AG (DE) 1984-12-19 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
EP-0043411-B1 REACTIVE DISAZO DYESTUFFS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING MATERIALS CONTAINING NITROGEN AND/OR HYDROXYLE GROUPS BAYER AG (DE) 1984-07-11 EP disclosed
EP-0097289-A2 Azo dyestuffs BAYER AG (DE) 1984-01-04 EP disclosed
EP-0050266-A1 Reactive disazo dyes, process for their preparation and their use in dyeing and printing materials that contain hydroxyl and/or nitrogen BAYER AG (DE) 1982-04-28 EP disclosed
EP-0043411-A2 Reactive disazo dyestuffs, process for their preparation and their use in dyeing and printing materials containing nitrogen and/or hydroxyle groups BAYER AG (DE) 1982-01-13 EP disclosed