SCHEMBL4471752

SCHEMBL4471752

CCCCCCCCCCCCCCCCCC[C](C)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.46
F2R P25116 1/20 0.43
TSHR P16473 2/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KMT2A Q03164 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL9142499 1.00 P2RX7 (0.46) P2RX7F2RTSHRCES2CES1
SCHEMBL9803829 1.00 P2RX7 (0.46) P2RX7F2RTSHRCES2CES1
SCHEMBL9146058 1.00 P2RX7 (0.46) P2RX7F2RTSHRCES2CES1
SCHEMBL816754 1.00 P2RX7 (0.46) P2RX7F2RTSHRCES2CES1
SCHEMBL10594865 1.00 P2RX7 (0.46) P2RX7F2RTSHRCES2CES1
SCHEMBL815607 0.98 F2R (0.44) P2RX7F2RTSHRCES2CES1
SCHEMBL815730 0.92 F2R (0.45) F2RTSHRCES2CES1ALDH1A1
SCHEMBL7199401 0.87 P2RX7 (0.42) P2RX7F2RTSHRCES2CES1
SCHEMBL817135 0.84 SMN1; SMN2 (0.50) F2RTSHRALDH1A1SMN1; SMN2KMT2A
SCHEMBL10937745 0.80 CHRM1 (0.56) P2RX7TSHRCES2CES1ALDH1A1

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
CN-1045362-C Bactericidal composition containing iodide GARCIA NUNEZ MARIA ROSALIA (ES) 1999-10-06 CN claimed
US-8206814-B2 Film made from denatured clay NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-06-26 US disclosed
US-20090202806-A1 FILM MADE FROM DENATURED CLAY NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2009-08-13 US disclosed
EP-1299467-A1 METHOD FOR PRODUCING NANOREINFORCED THERMOPLASTIC POLYMERS THÜRINGISCHES INSTITUT FÜR TEXTIL- UND KUNSTSTOFF-FORSCHUNG e.V. (DE) 2003-04-09 EP disclosed
WO-2001096459-A1 METHOD FOR PRODUCING NANOREINFORCED THERMOPLASTIC POLYMERS Thüringisches Institut für Textil-und Kunststoff-Forschung E.V. (DE) 2001-12-20 WO disclosed
US-6190819-B1 Electrostatic image-developing toner MITSUBISHI CHEMICAL CORPORATION (JP) 2001-02-20 US disclosed
EP-0802930-A1 FOAMS MADE FROM HIGH INTERNAL PHASE EMULSIONS USEFUL AS ABSORBENT MEMBERS FOR CATAMENIAL PADS THE PROCTER & GAMBLE COMPANY (US) 1997-10-29 EP disclosed
WO-1996021682-A1 FOAMS MADE FROM HIGH INTERNAL PHASE EMULSIONS USEFUL AS ABSORBENT MEMBERS FOR CATAMENIAL PADS THE PROCTER & GAMBLE COMPANY (US) 1996-07-18 WO disclosed
EP-0507890-B1 OLIGOMERIC THIOCARBONATES UNION OIL CO (US) 1995-05-17 EP disclosed
US-5393778-A Pesticides, preservatives, fungicides, fumigation UNION OIL COMPANY OF CALIFORNIA (US) 1995-02-28 US disclosed
US-5384329-A Pesticides, nematosides, insecticides or fungicides UNION OIL COMPANY OF CALIFORNIA (US) 1995-01-24 US disclosed
US-5288753-A Method of controlling animal and fungal pests with oligomeric thiocarbonates UNION OIL COMPANY OF CALIFORNIA (US) 1994-02-22 US disclosed
EP-0507890-A1 OLIGOMERIC THIOCARBONATES. UNION OIL CO (US) 1992-10-14 EP disclosed
US-5041275-A Antimicrobial agents UNION OIL COMPANY OF CALIFORNIA (US) 1991-08-20 US disclosed
WO-1991009526-A2 OLIGOMERIC THIOCARBONATES UNION OIL COMPANY OF CALIFORNIA (US) 1991-07-11 WO disclosed