SCHEMBL5653872

SCHEMBL5653872

C=C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.64
ALDH1A1 P00352 2/20 0.60
ATM Q13315 2/20 0.60
PBRM1 Q86U86 1/20 0.60
NR4A2 P43354 2/20 0.59
CREBBP Q92793 1/20 0.59
MAPK1 P28482 1/20 0.55
KMT2A Q03164 3/20 0.51
ADAM17 P78536 1/20 0.51
CTNNB1 P35222 1/20 0.50
WNT3A P56704 1/20 0.50
TP53 P04637 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49
PIM1 P11309 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL27656436 0.88 CTNNB1 (0.57) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL28013222 0.85 GPR84 (0.62) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL4102435 0.83 GPR84 (0.60) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL13134166 0.83 PBRM1 (0.67) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL12903083 0.83 NR4A2 (0.65) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL15455729 0.82 GPR84 (0.50) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL8616921 0.82 NR4A2 (0.48) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL4789278 0.81 MAPT (0.54) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL6159899 0.80 GPR84 (0.56) GPR84ALDH1A1ATMPBRM1NR4A2
SCHEMBL28756644 0.79 GPR84 (0.71) GPR84ALDH1A1ATMPBRM1NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2919998-A1 COLOUR-FORMING MATERIALS, CONTACT RECORDING DEVICES AND PRESSURE RECORDING DEVICES Active Device Development Limited (GB) 2015-09-23 EP claimed
WO-2014076468-A1 COLOUR-FORMING MATERIALS, CONTACT RECORDING DEVICES AND PRESSURE RECORDING DEVICES ACTIVE DEVICE DEVELOPMENT LIMITED (GB) 2014-05-22 WO claimed
US-5229522-A Reaction of indole and acetic anhydride with Lewis acids as catalysts APPLETON PAPERS INC. (US) 1993-07-20 US claimed
US-5116978-A Vilsmeir reagent APPLETON PAPERS INC. (US) 1992-05-26 US claimed
EP-0325708-B1 BIS-INDOLYL ETHYLENE DERIVATIVES BAYER AG (DE) 1992-03-18 EP claimed
EP-0315902-B1 BIS-INDOLYL ETHYLENE ALDEHYDES BAYER AG (DE) 1992-03-18 EP claimed
US-5086171-A Pressure-sensitive or heat-sensitive mark-forming record systems APPLETON PAPERS INC. (US) 1992-02-04 US claimed
US-5039821-A Process for producing di[bis-(indolyl)ethylenyl]tetrahalophthalides APPLETON PAPERS INC. (US) 1991-08-13 US claimed
US-5001105-A Bis-(indoly)ethylenes record systems utilizing such compounds APPLETON PAPERS INC. (US) 1991-03-19 US claimed
US-4996328-A Chromogens APPLETON PAPERS INC. (US) 1991-02-26 US claimed
EP-0386992-A2 Colour formers for recording sheets APPLETON PAPERS INC. (US) 1990-09-12 EP claimed
US-4931567-A Bis(indolyl)ethylene compounds BAYER AKTIENGESELLSCHAFT (DE) 1990-06-05 US claimed
US-4897494-A REACTING INDOLES WITH CARBOXYLIC ACID IN PRESENCE OF PHOSPHORUS OXYCHLORIDE BAYER AKTIENGESELLSCHAFT (DE) 1990-01-30 US claimed
EP-0325708-A1 Bis-indolyl ethylene derivatives BAYER AG (DE) 1989-08-02 EP claimed
EP-0315902-A1 Bis-indolyl ethylene aldehydes BAYER AG (DE) 1989-05-17 EP claimed
JP-3149264-A None JP disclosed
JP-7150057-A None JP disclosed
EP-0325708-A1 Bis-indolyl ethylene derivatives BAYER AG (DE) 1989-08-02 EP disclosed
EP-0325708-A1 Bis-indolyl ethylene derivatives BAYER AG (DE) 1989-08-02 EP disclosed
US-4659841-A REACTING ANILINES AND 1,2-GLYCOLS IN A LIQUID PHASE, CADIUM BROMIDE OR IODINE/POTASSIUM BROMIDE OR IODINE CATALYST RESEARCH ASSOCIATION FOR UTILIZATION OF LIGHT OIL (JP) 1987-04-21 US disclosed